Mitomycin C analog
TL;DR: Mitomycin C analog (CAS 86689-60-3) is a chemical compound with molecular formula C20H29N5O5 and molecular weight 419.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4R,6R,8R)-11-[2-(dimethylamino)ethyl-methylamino]-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: Mitomycin C analog, [(1aR,8R,8bR)-6-{[2-(Dimethylamino)ethyl](methyl)amino}-8a-methoxy-5-methyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazirino[2',3':3,4]pyrrolo[1,2-a]indol-8-yl]methyl carbamate, [(4R,6R,8R)-11-[2-(dimethylamino)ethyl-methylamino]-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
| Molecular Formula | C20H29N5O5 |
|---|---|
| Molecular Weight | 419.22 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 419.21686 |
| Heavy Atoms | 30 |
| Complexity | 881.0 |
Chemical Identifiers
| CAS Number | 86689-60-3 |
|---|---|
| SMILES | CC1=C(C(=O)C2=C(C1=O)N3C[C@@H]4[C@H](C3([C@H]2COC(=O)N)OC)N4)N(C)CCN(C)C |
| InChIKey | KNDFPSMFWBUTAB-YCTCWPPBSA-N |
Product Overview
Mitomycin C analog (CAS 86689-60-3), with molecular formula C20H29N5O5 and molecular weight 419.22 g/mol. IUPAC: [(4R,6R,8R)-11-[2-(dimethylamino)ethyl-methylamino]-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 Mitomycin C analog
Property Insights of Mitomycin C analog
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Mitomycin C analog. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Mitomycin C analog. Following Lipinski's Rule of Five, Mitomycin C analog has 2 hydrogen bond donor(s) and 9 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 Mitomycin C analog?
The CAS number of Mitomycin C analog is 86689-60-3.
What is the molecular formula of Mitomycin C analog?
The molecular formula of Mitomycin C analog is C20H29N5O5.
What is the molecular weight of Mitomycin C analog?
The molecular weight of Mitomycin C analog is 419.22 g/mol.
Where can I buy Mitomycin C analog?
You can request a quote for Mitomycin C analog directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mitomycin C analog?
Yes, KEHONG BIO provides custom synthesis services for Mitomycin C analog and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.