Mitomycin C methylamine
TL;DR: Mitomycin C methylamine (CAS 4117-85-5) is a chemical compound with molecular formula C16H20N4O5 and molecular weight 348.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[7-methoxy-12-methyl-11-(methylamino)-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 methylamine, KST-1A5525, NCI60_002865, [8a-methoxy-5-methyl-6-(methylamino)-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, MITOMYCIN C,METHYLAMINE FR. STREPTOMYCES CAESPITOSUS
| Molecular Formula | C16H20N4O5 |
|---|---|
| Molecular Weight | 348.14 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 348.14337 |
| Heavy Atoms | 25 |
| Complexity | 772.0 |
Chemical Identifiers
| CAS Number | 4117-85-5 |
|---|---|
| SMILES | CC1=C(C(=O)C2=C(C1=O)N3CC4C(C3(C2COC(=O)N)OC)N4)NC |
| InChIKey | QMWMHVONMWSXDM-UHFFFAOYSA-N |
Product Overview
Mitomycin C methylamine (CAS 4117-85-5), with molecular formula C16H20N4O5 and molecular weight 348.14 g/mol. IUPAC: [7-methoxy-12-methyl-11-(methylamino)-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 methylamine
Property Insights of Mitomycin C methylamine
The XLogP value of -0.3 indicates that Mitomycin C methylamine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Mitomycin C methylamine. Following Lipinski's Rule of Five, Mitomycin C methylamine 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 Mitomycin C methylamine?
The CAS number of Mitomycin C methylamine is 4117-85-5.
What is the molecular formula of Mitomycin C methylamine?
The molecular formula of Mitomycin C methylamine is C16H20N4O5.
What is the molecular weight of Mitomycin C methylamine?
The molecular weight of Mitomycin C methylamine is 348.14 g/mol.
Where can I buy Mitomycin C methylamine?
You can request a quote for Mitomycin C methylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mitomycin C methylamine?
Yes, KEHONG BIO provides custom synthesis services for Mitomycin C methylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.