BAS 07418025
TL;DR: BAS 07418025 (CAS 354556-39-1) is a chemical compound with molecular formula C22H22N2O3S and molecular weight 394.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxobutanoate
Also Known As: BAS 07418025, propan-2-yl 4-[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxobutanoate, 4-(3-Cyano-4-phenyl-6,7-dihydro-5H-[1]pyrindin-2-ylsulfanyl)-3-oxo-butyric acid, isopropyl 4-((3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)-3-oxobutanoate
| Molecular Formula | C22H22N2O3S |
|---|---|
| Molecular Weight | 394.14 g/mol |
| LogP | 4.11188 |
| Topological Polar Surface Area | 80.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 394.1351 |
| Heavy Atoms | 28 |
| Complexity | 933.03345 |
Chemical Identifiers
| CAS Number | 354556-39-1 |
|---|---|
| SMILES | CC(C)OC(=O)CC(=O)CSC1=NC2=C(CCC2)C(=C1C#N)C3=CC=CC=C3 |
Product Overview
BAS 07418025 (CAS 354556-39-1), with molecular formula C22H22N2O3S and molecular weight 394.14 g/mol. IUPAC: propan-2-yl 4-[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxobutanoate.
Chemical Property Profile of BAS 07418025
Property Insights of BAS 07418025
The XLogP value of 4.11188 indicates that BAS 07418025 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.05 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07418025. Following Lipinski's Rule of Five, BAS 07418025 has 0 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 07418025?
The CAS number of BAS 07418025 is 354556-39-1.
What is the molecular formula of BAS 07418025?
The molecular formula of BAS 07418025 is C22H22N2O3S.
What is the molecular weight of BAS 07418025?
The molecular weight of BAS 07418025 is 394.14 g/mol.
Where can I buy BAS 07418025?
You can request a quote for BAS 07418025 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07418025?
Yes, KEHONG BIO provides custom synthesis services for BAS 07418025 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.