BAS 00865832
TL;DR: BAS 00865832 (CAS 277756-55-5) is a chemical compound with molecular formula C21H20N4O2S2 and molecular weight 424.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-amino-2-oxoethyl)sulfanyl-5-cyano-2-methyl-N-(2-methylphenyl)-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide
Also Known As: BAS 00865832, AB00080490-01, 6-[(2-Amino-2-oxoethyl)thio]-5-cyano-1,4-dihydro-2-methyl-N-(2-methylphenyl)-4-(2-thienyl)-3-pyridinecarboxamide, 6-(2-amino-2-oxoethyl)sulfanyl-5-cyano-2-methyl-N-(2-methylphenyl)-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide, 6-[(carbamoylmethyl)sulfanyl]-5-cyano-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
| Molecular Formula | C21H20N4O2S2 |
|---|---|
| Molecular Weight | 424.10 g/mol |
| LogP | 3.6097 |
| Topological Polar Surface Area | 108.01 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 424.10278 |
| Heavy Atoms | 29 |
| Complexity | 1048.8834 |
Chemical Identifiers
| CAS Number | 277756-55-5 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)C2=C(NC(=C(C2C3=CC=CS3)C#N)SCC(=O)N)C |
Product Overview
BAS 00865832 (CAS 277756-55-5), with molecular formula C21H20N4O2S2 and molecular weight 424.10 g/mol. IUPAC: 6-(2-amino-2-oxoethyl)sulfanyl-5-cyano-2-methyl-N-(2-methylphenyl)-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide.
Chemical Property Profile of BAS 00865832
Property Insights of BAS 00865832
The XLogP value of 3.6097 indicates that BAS 00865832 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.01 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00865832. Following Lipinski's Rule of Five, BAS 00865832 has 3 hydrogen bond donor(s) and 6 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 BAS 00865832?
The CAS number of BAS 00865832 is 277756-55-5.
What is the molecular formula of BAS 00865832?
The molecular formula of BAS 00865832 is C21H20N4O2S2.
What is the molecular weight of BAS 00865832?
The molecular weight of BAS 00865832 is 424.10 g/mol.
Where can I buy BAS 00865832?
You can request a quote for BAS 00865832 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00865832?
Yes, KEHONG BIO provides custom synthesis services for BAS 00865832 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.