丝裂霉素A
TL;DR: 丝裂霉素A (CAS 4055-39-4) is a chemical compound with molecular formula C16H19N3O6 and molecular weight 349.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丝裂霉素A
(7,11-dimethoxy-12-methyl-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl)methyl carbamate
Also Known As: Mitomycin A, (6,8a-Dimethoxy-5-methyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazireno[2',3':3,4]pyrrolo[1,2-a]indol-8-yl)methyl carbamate #, {7,11-dimethoxy-12-methyl-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl}methyl carbamate, 6,8a-Dimethoxy-8-[(carbamoyloxy)methyl]-5-methyl-1,1a,2,8,8a,8b-hexahydroazirino[2 ,3 :3,4]pyrrolo[1,2-a]indole-4,7-dione, Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-8-(hydroxymethyl)-6,8a-dimethoxy-5-methyl-, carbamate
| Molecular Formula | C16H19N3O6 |
|---|---|
| Molecular Weight | 349.13 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 349.12738 |
| Heavy Atoms | 25 |
| Complexity | 772.0 |
Chemical Identifiers
| CAS Number | 4055-39-4 |
|---|---|
| SMILES | CC1=C(C(=O)C2=C(C1=O)N3CC4C(C3(C2COC(=O)N)OC)N4)OC |
| InChIKey | HYFMSAFINFJTFH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丝裂霉素A (CAS 4055-39-4), with molecular formula C16H19N3O6 and molecular weight 349.13 g/mol. IUPAC: (7,11-dimethoxy-12-methyl-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl)methyl carbamate.
Chemical Property Profile of 丝裂霉素A
Property Insights of 丝裂霉素A
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 丝裂霉素A. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 丝裂霉素A. Following Lipinski's Rule of Five, 丝裂霉素A 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 丝裂霉素A?
The CAS number of 丝裂霉素A is 4055-39-4.
What is the molecular formula of 丝裂霉素A?
The molecular formula of 丝裂霉素A is C16H19N3O6.
What is the molecular weight of 丝裂霉素A?
The molecular weight of 丝裂霉素A is 349.13 g/mol.
Where can I buy 丝裂霉素A?
You can request a quote for 丝裂霉素A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丝裂霉素A?
Yes, KEHONG BIO provides custom synthesis services for 丝裂霉素A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.