RUTAMYCIN
TL;DR: RUTAMYCIN (CAS 3930-76-5) is a chemical compound with molecular formula C20H25N5O5P2 and molecular weight 477.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-amino-1-[aziridin-1-yl-[4-[bis(aziridin-1-yl)phosphoryloxy]phenoxy]phosphoryl]-2H-pyridin-5-yl]prop-2-en-1-one
Also Known As: RUTAMYCIN, A-272, Phosphonamidic acid, p-(1-aziridinyl)-N-(2-nicotinoylethyl)-, p-((bis(1-aziridinyl)phosphinyl)oxy)phenyl ester, 4-{[bis(aziridin-1-yl)phosphoryl]oxy}phenyl(5-acryloyl-3-aminopyridin-1(2h)-yl)aziridin-1-ylphosphinate(non-preferred name), 1-[3-amino-1-[aziridin-1-yl-[4-[bis(aziridin-1-yl)phosphoryloxy]phenoxy]phosphoryl]-2H-pyridin-5-yl]prop-2-en-1-one
| Molecular Formula | C20H25N5O5P2 |
|---|---|
| Molecular Weight | 477.13 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 477.1331 |
| Heavy Atoms | 32 |
| Complexity | 932.0 |
Chemical Identifiers
| CAS Number | 3930-76-5 |
|---|---|
| SMILES | C=CC(=O)C1=CN(CC(=C1)N)P(=O)(N2CC2)OC3=CC=C(C=C3)OP(=O)(N4CC4)N5CC5 |
| InChIKey | ANTIVHHDTMXRCT-UHFFFAOYSA-N |
Product Overview
RUTAMYCIN (CAS 3930-76-5), with molecular formula C20H25N5O5P2 and molecular weight 477.13 g/mol. IUPAC: 1-[3-amino-1-[aziridin-1-yl-[4-[bis(aziridin-1-yl)phosphoryloxy]phenoxy]phosphoryl]-2H-pyridin-5-yl]prop-2-en-1-one.
Chemical Property Profile of RUTAMYCIN
Property Insights of RUTAMYCIN
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RUTAMYCIN. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RUTAMYCIN. Following Lipinski's Rule of Five, RUTAMYCIN has 1 hydrogen bond donor(s) and 10 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 RUTAMYCIN?
The CAS number of RUTAMYCIN is 3930-76-5.
What is the molecular formula of RUTAMYCIN?
The molecular formula of RUTAMYCIN is C20H25N5O5P2.
What is the molecular weight of RUTAMYCIN?
The molecular weight of RUTAMYCIN is 477.13 g/mol.
Where can I buy RUTAMYCIN?
You can request a quote for RUTAMYCIN directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RUTAMYCIN?
Yes, KEHONG BIO provides custom synthesis services for RUTAMYCIN and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.