BAS 00635117
TL;DR: BAS 00635117 (CAS 201281-03-0) is a chemical compound with molecular formula C22H19N3O2S and molecular weight 389.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-cyano-4-(4-methoxyphenyl)-2-methyl-6-methylsulfanyl-N-phenylpyridine-3-carboxamide
Also Known As: BAS 00635117, VU0002256-1, AE-848/32950048, 5-CYANO-4-(4-METHOXYPHENYL)-2-METHYL-6-(METHYLSULFANYL)-N-PHENYLNICOTINAMIDE, 5-cyano-4-(4-methoxyphenyl)-2-methyl-6-(methylsulfanyl)-N-phenylpyridine-3-carboxamide
| Molecular Formula | C22H19N3O2S |
|---|---|
| Molecular Weight | 389.12 g/mol |
| LogP | 4.9115 |
| Topological Polar Surface Area | 75.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 389.1198 |
| Heavy Atoms | 28 |
| Complexity | 1042.1173 |
Chemical Identifiers
| CAS Number | 201281-03-0 |
|---|---|
| SMILES | CC1=C(C(=C(C(=N1)SC)C#N)C2=CC=C(C=C2)OC)C(=O)NC3=CC=CC=C3 |
Product Overview
BAS 00635117 (CAS 201281-03-0), with molecular formula C22H19N3O2S and molecular weight 389.12 g/mol. IUPAC: 5-cyano-4-(4-methoxyphenyl)-2-methyl-6-methylsulfanyl-N-phenylpyridine-3-carboxamide.
Chemical Property Profile of BAS 00635117
Property Insights of BAS 00635117
The XLogP value of 4.9115 indicates that BAS 00635117 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.01 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00635117. Following Lipinski's Rule of Five, BAS 00635117 has 1 hydrogen bond donor(s) and 5 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 00635117?
The CAS number of BAS 00635117 is 201281-03-0.
What is the molecular formula of BAS 00635117?
The molecular formula of BAS 00635117 is C22H19N3O2S.
What is the molecular weight of BAS 00635117?
The molecular weight of BAS 00635117 is 389.12 g/mol.
Where can I buy BAS 00635117?
You can request a quote for BAS 00635117 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00635117?
Yes, KEHONG BIO provides custom synthesis services for BAS 00635117 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.