AM-807/13612031
TL;DR: AM-807/13612031 (CAS 354555-15-0) is a chemical compound with molecular formula C21H22N2O6S and molecular weight 430.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-cyano-4-(4-methoxycarbonylphenyl)-6-(2-methoxy-2-oxoethyl)sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate
Also Known As: AM-807/13612031, ethyl 5-cyano-4-(4-methoxycarbonylphenyl)-6-(2-methoxy-2-oxoethyl)sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate, ethyl 5-cyano-6-((2-methoxy-2-oxoethyl)thio)-4-(4-(methoxycarbonyl)phenyl)-2-methyl-1,4-dihydropyridine-3-carboxylate, ethyl 5-cyano-4-[4-(methoxycarbonyl)phenyl]-6-[(2-methoxy-2-oxoethyl)sulfanyl]-2-methyl-1,4-dihydropyridine-3-carboxylate, ethyl 5-cyano-4-[4-(methoxycarbonyl)phenyl]-6-[(2-methoxy-2-oxoethyl)sulfanyl]-2-methyl-1,4-dihydro-3-pyridinecarboxylate
| Molecular Formula | C21H22N2O6S |
|---|---|
| Molecular Weight | 430.12 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 430.11984 |
| Heavy Atoms | 30 |
| Complexity | 802.0 |
Chemical Identifiers
| CAS Number | 354555-15-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=C(C1C2=CC=C(C=C2)C(=O)OC)C#N)SCC(=O)OC)C |
| InChIKey | FSPIIMLVWZQWBJ-UHFFFAOYSA-N |
Product Overview
AM-807/13612031 (CAS 354555-15-0), with molecular formula C21H22N2O6S and molecular weight 430.12 g/mol. IUPAC: ethyl 5-cyano-4-(4-methoxycarbonylphenyl)-6-(2-methoxy-2-oxoethyl)sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate.
Chemical Property Profile of AM-807/13612031
Property Insights of AM-807/13612031
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AM-807/13612031. The TPSA of 140.0 Ų indicates high polarity, suggesting AM-807/13612031 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AM-807/13612031 has 1 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 AM-807/13612031?
The CAS number of AM-807/13612031 is 354555-15-0.
What is the molecular formula of AM-807/13612031?
The molecular formula of AM-807/13612031 is C21H22N2O6S.
What is the molecular weight of AM-807/13612031?
The molecular weight of AM-807/13612031 is 430.12 g/mol.
Where can I buy AM-807/13612031?
You can request a quote for AM-807/13612031 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AM-807/13612031?
Yes, KEHONG BIO provides custom synthesis services for AM-807/13612031 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.