![methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt structure](/static/products/1318/13186-09-9.webp)
methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt
TL;DR: methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt (CAS 13186-09-9) is a chemical compound with molecular formula C18H24N5O5+ and molecular weight 390.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4S,6S,7R,8S)-11-(dimethylaminomethylideneamino)-7-methoxy-12-methyl-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate;hydron
Also Known As: methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt, 1,1a,2,4,7 ,8,8a,8b-Octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino(2',3':3,4)pyrrolo(1,2-a)indol-6-yl)aminomethylene-N-methylmethanaminium, 1,1a,2,4,7,8,8a,8b-Octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino(2',3':3,4)pyrrolo(1,2-a)indol-6-yl)aminomethylene-N-methylmethanaminium
| Molecular Formula | C18H24N5O5+ |
|---|---|
| Molecular Weight | 390.18 g/mol |
| LogP | -0.9075 |
| Topological Polar Surface Area | 136.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 390.17773 |
| Heavy Atoms | 28 |
| Complexity | 876.0 |
Chemical Identifiers
| CAS Number | 13186-09-9 |
|---|---|
| SMILES | [H+].CC1=C(C(=O)C2=C(C1=O)N3C[C@H]4[C@@H]([C@@]3([C@@H]2COC(=O)N)OC)N4)N=CN(C)C |
| InChIKey | WZMFNIVNLYRDDE-QJIICXBUSA-O |
Product Overview
methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt (CAS 13186-09-9), with molecular formula C18H24N5O5+ and molecular weight 390.18 g/mol. IUPAC: [(4S,6S,7R,8S)-11-(dimethylaminomethylideneamino)-7-methoxy-12-methyl-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate;hydron.
Chemical Property Profile of methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt
Property Insights of methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt
The XLogP value of -0.9075 indicates that methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt. Following Lipinski's Rule of Five, methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt?
The CAS number of methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt is 13186-09-9.
What is the molecular formula of methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt?
The molecular formula of methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt is C18H24N5O5+.
What is the molecular weight of methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt?
The molecular weight of methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt is 390.18 g/mol.
Where can I buy methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt?
You can request a quote for methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt?
Yes, KEHONG BIO provides custom synthesis services for methanimidamide, n'-[(1as,8s,8ar,8bs)-8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,4,7,8,8a,8b-octahydro-8a-methoxy-5-methyl-4,7-dioxoazirino[2',3':3,4]pyrrolo[1,2-a]indol-6-yl]-n,n-dimethyl-, hydrogen salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.