BAS 01235431
TL;DR: BAS 01235431 (CAS 5915-39-9) is a chemical compound with molecular formula C22H21N3O3S and molecular weight 407.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-cyano-4-(furan-2-yl)-N-(2-methoxyphenyl)-2-methyl-6-prop-2-enylsulfanyl-1,4-dihydropyridine-3-carboxamide
Also Known As: BAS 01235431, BIM-0037059.P001, AB00100667-01, 5-cyano-4-(furan-2-yl)-N-(2-methoxyphenyl)-2-methyl-6-(prop-2-en-1-ylsulfanyl)-1,4-dihydropyridine-3-carboxamide, 6-(allylthio)-5-cyano-4-(2-furyl)-N-(2-methoxyphenyl)-2-methyl-1,4-dihydro-3-pyridinecarboxamide
| Molecular Formula | C22H21N3O3S |
|---|---|
| Molecular Weight | 407.13 g/mol |
| LogP | 4.54208 |
| Topological Polar Surface Area | 87.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 407.13037 |
| Heavy Atoms | 29 |
| Complexity | 1016.1735 |
Chemical Identifiers
| CAS Number | 5915-39-9 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)SCC=C)C#N)C2=CC=CO2)C(=O)NC3=CC=CC=C3OC |
Product Overview
BAS 01235431 (CAS 5915-39-9), with molecular formula C22H21N3O3S and molecular weight 407.13 g/mol. IUPAC: 5-cyano-4-(furan-2-yl)-N-(2-methoxyphenyl)-2-methyl-6-prop-2-enylsulfanyl-1,4-dihydropyridine-3-carboxamide.
Chemical Property Profile of BAS 01235431
Property Insights of BAS 01235431
The XLogP value of 4.54208 indicates that BAS 01235431 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.29 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01235431. Following Lipinski's Rule of Five, BAS 01235431 has 2 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 01235431?
The CAS number of BAS 01235431 is 5915-39-9.
What is the molecular formula of BAS 01235431?
The molecular formula of BAS 01235431 is C22H21N3O3S.
What is the molecular weight of BAS 01235431?
The molecular weight of BAS 01235431 is 407.13 g/mol.
Where can I buy BAS 01235431?
You can request a quote for BAS 01235431 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01235431?
Yes, KEHONG BIO provides custom synthesis services for BAS 01235431 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.