BAS 05594516
TL;DR: BAS 05594516 (CAS 672265-93-9) is a chemical compound with molecular formula C19H14F3N3O2S and molecular weight 405.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-5-oxo-N-[2-(trifluoromethyl)phenyl]-7,8-dihydro-6H-thieno[2,3-b]quinoline-2-carboxamide
Also Known As: BAS 05594516, 3-amino-5-oxo-N-(2-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide, 3-amino-5-oxo-N-[2-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide, 3-AMINO-5-OXO-N-[2-(TRIFLUOROMETHYL)PHENYL]-5H,6H,7H,8H-THIENO[2,3-B]QUINOLINE-2-CARBOXAMIDE, 3-amino-5-oxo-N-[2-(trifluoromethyl)phenyl]-7,8-dihydro-6H-thieno[2,3-b]quinoline-2-carboxamide
| Molecular Formula | C19H14F3N3O2S |
|---|---|
| Molecular Weight | 405.08 g/mol |
| LogP | 4.6686 |
| Topological Polar Surface Area | 85.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 405.0759 |
| Heavy Atoms | 28 |
| Complexity | 1121.5447 |
Chemical Identifiers
| CAS Number | 672265-93-9 |
|---|---|
| SMILES | C1CC2=C(C=C3C(=C(SC3=N2)C(=O)NC4=CC=CC=C4C(F)(F)F)N)C(=O)C1 |
Product Overview
BAS 05594516 (CAS 672265-93-9), with molecular formula C19H14F3N3O2S and molecular weight 405.08 g/mol. IUPAC: 3-amino-5-oxo-N-[2-(trifluoromethyl)phenyl]-7,8-dihydro-6H-thieno[2,3-b]quinoline-2-carboxamide.
Chemical Property Profile of BAS 05594516
Property Insights of BAS 05594516
The XLogP value of 4.6686 indicates that BAS 05594516 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.08 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05594516. Following Lipinski's Rule of Five, BAS 05594516 has 2 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 05594516?
The CAS number of BAS 05594516 is 672265-93-9.
What is the molecular formula of BAS 05594516?
The molecular formula of BAS 05594516 is C19H14F3N3O2S.
What is the molecular weight of BAS 05594516?
The molecular weight of BAS 05594516 is 405.08 g/mol.
Where can I buy BAS 05594516?
You can request a quote for BAS 05594516 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05594516?
Yes, KEHONG BIO provides custom synthesis services for BAS 05594516 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.