BAS 06901320
TL;DR: BAS 06901320 (CAS 625376-64-9) is a chemical compound with molecular formula C15H15F3N2O2S and molecular weight 344.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[3-cyano-6-cyclopropyl-4-(trifluoromethyl)-2-pyridinyl]sulfanyl]propanoate
Also Known As: BAS 06901320, ethyl 2-{[3-cyano-6-cyclopropyl-4-(trifluoromethyl)-2-pyridinyl]sulfanyl}propanoate, ethyl 2-[3-cyano-6-cyclopropyl-4-(trifluoromethyl)pyridin-2-yl]sulfanylpropanoate, ethyl 2-{[3-cyano-6-cyclopropyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}propanoate, 2-(3-Cyano-6-cyclopropyl-4-trifluoromethyl-pyridin-2-ylsulfanyl)-propionic acid
| Molecular Formula | C15H15F3N2O2S |
|---|---|
| Molecular Weight | 344.08 g/mol |
| LogP | 3.89318 |
| Topological Polar Surface Area | 62.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 344.08063 |
| Heavy Atoms | 23 |
| Complexity | 651.34766 |
Chemical Identifiers
| CAS Number | 625376-64-9 |
|---|---|
| SMILES | CCOC(=O)C(C)SC1=C(C(=CC(=N1)C2CC2)C(F)(F)F)C#N |
Product Overview
BAS 06901320 (CAS 625376-64-9), with molecular formula C15H15F3N2O2S and molecular weight 344.08 g/mol. IUPAC: ethyl 2-[[3-cyano-6-cyclopropyl-4-(trifluoromethyl)-2-pyridinyl]sulfanyl]propanoate.
Chemical Property Profile of BAS 06901320
Property Insights of BAS 06901320
The XLogP value of 3.89318 indicates that BAS 06901320 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.98 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06901320. Following Lipinski's Rule of Five, BAS 06901320 has 0 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 06901320?
The CAS number of BAS 06901320 is 625376-64-9.
What is the molecular formula of BAS 06901320?
The molecular formula of BAS 06901320 is C15H15F3N2O2S.
What is the molecular weight of BAS 06901320?
The molecular weight of BAS 06901320 is 344.08 g/mol.
Where can I buy BAS 06901320?
You can request a quote for BAS 06901320 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06901320?
Yes, KEHONG BIO provides custom synthesis services for BAS 06901320 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.