BAS 06900339
TL;DR: BAS 06900339 (CAS 445382-36-5) is a chemical compound with molecular formula C19H16F3N3O2S and molecular weight 407.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide
Also Known As: BAS 06900339, 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide, AM-807/14146435, 2-[(3-cyano-5,6,7,8-tetrahydro-2-quinolinyl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide, 2-((3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio)-N-(4-(trifluoromethoxy)phenyl)acetamide
| Molecular Formula | C19H16F3N3O2S |
|---|---|
| Molecular Weight | 407.09 g/mol |
| LogP | 4.46148 |
| Topological Polar Surface Area | 75.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 407.09152 |
| Heavy Atoms | 28 |
| Complexity | 908.3655 |
Chemical Identifiers
| CAS Number | 445382-36-5 |
|---|---|
| SMILES | C1CCC2=NC(=C(C=C2C1)C#N)SCC(=O)NC3=CC=C(C=C3)OC(F)(F)F |
Product Overview
BAS 06900339 (CAS 445382-36-5), with molecular formula C19H16F3N3O2S and molecular weight 407.09 g/mol. IUPAC: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide.
Chemical Property Profile of BAS 06900339
Property Insights of BAS 06900339
The XLogP value of 4.46148 indicates that BAS 06900339 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.01 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06900339. Following Lipinski's Rule of Five, BAS 06900339 has 1 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 06900339?
The CAS number of BAS 06900339 is 445382-36-5.
What is the molecular formula of BAS 06900339?
The molecular formula of BAS 06900339 is C19H16F3N3O2S.
What is the molecular weight of BAS 06900339?
The molecular weight of BAS 06900339 is 407.09 g/mol.
Where can I buy BAS 06900339?
You can request a quote for BAS 06900339 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06900339?
Yes, KEHONG BIO provides custom synthesis services for BAS 06900339 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.