6-(N-Piperidino)mitomycin C
TL;DR: 6-(N-Piperidino)mitomycin C (CAS 4154-16-9) is a chemical compound with molecular formula C20H26N4O5 and molecular weight 402.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(7R,8S)-7-methoxy-12-methyl-10,13-dioxo-11-piperidin-1-yl-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate
Also Known As: 6-(N-Piperidino)mitomycin C, Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-8-(hydroxymethyl)-8a-methoxy-5-methyl-6-piperidino-, carbamate (ester), [(8S,8aR)-8a-Methoxy-5-methyl-4,7-dioxo-6-(piperidin-1-yl)-1,1a,2,4,7,8,8a,8b-octahydroazirino[2',3':3,4]pyrrolo[1,2-a]indol-8-yl]methyl hydrogen carbonimidate, [8a-Methoxy-5-methyl-4,7-dioxo-6-(piperidin-1-yl)-1,1a,2,4,7,8,8a,8b-octahydroazireno[2',3':3,4]pyrrolo[1,2-a]indol-8-yl]methyl hydrogen carbonimidate, AZIRINO(2',3':3,4)PYRROLO(1,2-a)INDOLE-4,7-DIONE, 1,1a,2,8,8a,8b-HEXAHYDRO-8-(HY
| Molecular Formula | C20H26N4O5 |
|---|---|
| Molecular Weight | 402.19 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 402.1903 |
| Heavy Atoms | 29 |
| Complexity | 874.0 |
Chemical Identifiers
| CAS Number | 4154-16-9 |
|---|---|
| SMILES | CC1=C(C(=O)C2=C(C1=O)N3CC4C([C@@]3([C@@H]2COC(=O)N)OC)N4)N5CCCCC5 |
| InChIKey | ORLOZWNXWWYWCA-WXRBLJGGSA-N |
Product Overview
6-(N-Piperidino)mitomycin C (CAS 4154-16-9), with molecular formula C20H26N4O5 and molecular weight 402.19 g/mol. IUPAC: [(7R,8S)-7-methoxy-12-methyl-10,13-dioxo-11-piperidin-1-yl-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate.
Chemical Property Profile of 6-(N-Piperidino)mitomycin C
Property Insights of 6-(N-Piperidino)mitomycin C
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(N-Piperidino)mitomycin C. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(N-Piperidino)mitomycin C. Following Lipinski's Rule of Five, 6-(N-Piperidino)mitomycin C has 2 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 6-(N-Piperidino)mitomycin C?
The CAS number of 6-(N-Piperidino)mitomycin C is 4154-16-9.
What is the molecular formula of 6-(N-Piperidino)mitomycin C?
The molecular formula of 6-(N-Piperidino)mitomycin C is C20H26N4O5.
What is the molecular weight of 6-(N-Piperidino)mitomycin C?
The molecular weight of 6-(N-Piperidino)mitomycin C is 402.19 g/mol.
Where can I buy 6-(N-Piperidino)mitomycin C?
You can request a quote for 6-(N-Piperidino)mitomycin C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(N-Piperidino)mitomycin C?
Yes, KEHONG BIO provides custom synthesis services for 6-(N-Piperidino)mitomycin C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.