3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate
TL;DR: 3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate (CAS 5329-55-5) is a chemical compound with molecular formula C32H35N3O4 and molecular weight 525.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[7-oxo-23-(propan-2-yloxymethyl)-3,13-diazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1(23),2(10),3,8,11,13,15,17(22),20-nonaen-19-yl]propyl 2-(dimethylamino)acetate
Also Known As: 3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate, 3-(9-Oxo-13-{[(propan-2-yl)oxy]methyl}-4,9,10,11-tetrahydro-3H-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl)propyl N,N-dimethylglycinate, Glycine, N,N-dimethyl-, 3-(5,6,7,13-tetrahydro-9-((1-methylethoxy)methyl)-5-oxo-12H-indeno(2,1-a)pyrrolo(3,4-c)carbazol-12-yl)propyl ester
| Molecular Formula | C32H35N3O4 |
|---|---|
| Molecular Weight | 525.26 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 80.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 525.26276 |
| Heavy Atoms | 39 |
| Complexity | 1440.0 |
Chemical Identifiers
| CAS Number | 5329-55-5 |
|---|---|
| SMILES | CC(C)OCC1=C2C(=C3C=NC=C3C4=C2N=C5C4=CC(=O)CC5)C6=C1C=CC(C6)CCCOC(=O)CN(C)C |
| InChIKey | MGDVJFUJVPEMAQ-UHFFFAOYSA-N |
Product Overview
3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate (CAS 5329-55-5), with molecular formula C32H35N3O4 and molecular weight 525.26 g/mol. IUPAC: 3-[7-oxo-23-(propan-2-yloxymethyl)-3,13-diazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1(23),2(10),3,8,11,13,15,17(22),20-nonaen-19-yl]propyl 2-(dimethylamino)acetate.
Chemical Property Profile of 3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate
Property Insights of 3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate. The TPSA of 80.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate. Following Lipinski's Rule of Five, 3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate?
The CAS number of 3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate is 5329-55-5.
What is the molecular formula of 3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate?
The molecular formula of 3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate is C32H35N3O4.
What is the molecular weight of 3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate?
The molecular weight of 3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate is 525.26 g/mol.
Where can I buy 3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate?
You can request a quote for 3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate?
Yes, KEHONG BIO provides custom synthesis services for 3-{9-oxo-13-[(propan-2-yloxy)methyl]-4,9,10,11-tetrahydro-3h-indeno[2,1-a]pyrrolo[3,4-c]carbazol-3-yl}propyl n,n-dimethylglycinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.