BAS 01235409
TL;DR: BAS 01235409 (CAS 330557-87-4) is a chemical compound with molecular formula C24H23N3O4S and molecular weight 449.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[3-cyano-5-[(2-methoxyphenyl)carbamoyl]-6-methyl-4-phenyl-1,4-dihydropyridin-2-yl]sulfanyl]acetate
Also Known As: BAS 01235409, AB00684298-01, AE-848/11420990, F0421-0050, methyl ({3-cyano-5-[(2-methoxyphenyl)carbamoyl]-6-methyl-4-phenyl-1,4-dihydropyridin-2-yl}sulfanyl)acetate
| Molecular Formula | C24H23N3O4S |
|---|---|
| Molecular Weight | 449.14 g/mol |
| LogP | 3.93608 |
| Topological Polar Surface Area | 100.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 449.14093 |
| Heavy Atoms | 32 |
| Complexity | 1119.5643 |
Chemical Identifiers
| CAS Number | 330557-87-4 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)SCC(=O)OC)C#N)C2=CC=CC=C2)C(=O)NC3=CC=CC=C3OC |
Product Overview
BAS 01235409 (CAS 330557-87-4), with molecular formula C24H23N3O4S and molecular weight 449.14 g/mol. IUPAC: methyl 2-[[3-cyano-5-[(2-methoxyphenyl)carbamoyl]-6-methyl-4-phenyl-1,4-dihydropyridin-2-yl]sulfanyl]acetate.
Chemical Property Profile of BAS 01235409
Property Insights of BAS 01235409
The XLogP value of 3.93608 indicates that BAS 01235409 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.45 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01235409. Following Lipinski's Rule of Five, BAS 01235409 has 2 hydrogen bond donor(s) and 7 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 01235409?
The CAS number of BAS 01235409 is 330557-87-4.
What is the molecular formula of BAS 01235409?
The molecular formula of BAS 01235409 is C24H23N3O4S.
What is the molecular weight of BAS 01235409?
The molecular weight of BAS 01235409 is 449.14 g/mol.
Where can I buy BAS 01235409?
You can request a quote for BAS 01235409 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01235409?
Yes, KEHONG BIO provides custom synthesis services for BAS 01235409 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.