N6-Phenylmitomycin C
TL;DR: N6-Phenylmitomycin C (CAS 14896-01-6) is a chemical compound with molecular formula C21H22N4O5 and molecular weight 410.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4S,6S,7R,8S)-11-anilino-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
Also Known As: N6-Phenylmitomycin C, 7-N-Phenyl-mitomycin C, N(6)-Phenylmitomycin C, N7-PHENYL-MITOMYCIN C, Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-anilino-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate
| Molecular Formula | C21H22N4O5 |
|---|---|
| Molecular Weight | 410.16 g/mol |
| LogP | 0.5022 |
| Topological Polar Surface Area | 132.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 410.15903 |
| Heavy Atoms | 30 |
| Complexity | 1033.0922 |
Chemical Identifiers
| CAS Number | 14896-01-6 |
|---|---|
| SMILES | CC1=C(C(=O)C2=C(C1=O)N3C[C@H]4[C@@H]([C@@]3([C@@H]2COC(=O)N)OC)N4)NC5=CC=CC=C5 |
Product Overview
N6-Phenylmitomycin C (CAS 14896-01-6), with molecular formula C21H22N4O5 and molecular weight 410.16 g/mol. IUPAC: [(4S,6S,7R,8S)-11-anilino-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.
Chemical Property Profile of N6-Phenylmitomycin C
Property Insights of N6-Phenylmitomycin C
The XLogP value of 0.5022 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N6-Phenylmitomycin C. The TPSA of 132.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N6-Phenylmitomycin C. Following Lipinski's Rule of Five, N6-Phenylmitomycin C 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 N6-Phenylmitomycin C?
The CAS number of N6-Phenylmitomycin C is 14896-01-6.
What is the molecular formula of N6-Phenylmitomycin C?
The molecular formula of N6-Phenylmitomycin C is C21H22N4O5.
What is the molecular weight of N6-Phenylmitomycin C?
The molecular weight of N6-Phenylmitomycin C is 410.16 g/mol.
Where can I buy N6-Phenylmitomycin C?
You can request a quote for N6-Phenylmitomycin C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N6-Phenylmitomycin C?
Yes, KEHONG BIO provides custom synthesis services for N6-Phenylmitomycin C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.