BAS 00635042
TL;DR: BAS 00635042 (CAS 201273-82-7) is a chemical compound with molecular formula C26H21N3O2S2 and molecular weight 471.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-cyano-2-methyl-6-phenacylsulfanyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide
Also Known As: BAS 00635042, BIM-0014680.P001, 5-cyano-2-methyl-6-[(2-oxo-2-phenylethyl)sulfanyl]-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide, F0837-0150, 5-cyano-2-methyl-6-phenacylsulfanyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide
| Molecular Formula | C26H21N3O2S2 |
|---|---|
| Molecular Weight | 471.11 g/mol |
| LogP | 5.69888 |
| Topological Polar Surface Area | 81.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 471.1075 |
| Heavy Atoms | 33 |
| Complexity | 1257.8805 |
Chemical Identifiers
| CAS Number | 201273-82-7 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)SCC(=O)C2=CC=CC=C2)C#N)C3=CC=CS3)C(=O)NC4=CC=CC=C4 |
Product Overview
BAS 00635042 (CAS 201273-82-7), with molecular formula C26H21N3O2S2 and molecular weight 471.11 g/mol. IUPAC: 5-cyano-2-methyl-6-phenacylsulfanyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide.
Chemical Property Profile of BAS 00635042
Property Insights of BAS 00635042
The XLogP value of 5.69888 indicates that BAS 00635042 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.99 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00635042. Following Lipinski's Rule of Five, BAS 00635042 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00635042?
The CAS number of BAS 00635042 is 201273-82-7.
What is the molecular formula of BAS 00635042?
The molecular formula of BAS 00635042 is C26H21N3O2S2.
What is the molecular weight of BAS 00635042?
The molecular weight of BAS 00635042 is 471.11 g/mol.
Where can I buy BAS 00635042?
You can request a quote for BAS 00635042 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00635042?
Yes, KEHONG BIO provides custom synthesis services for BAS 00635042 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.