A1497/0065643
TL;DR: A1497/0065643 (CAS 311784-12-0) is a chemical compound with molecular formula C25H24F3N3OS and molecular weight 471.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(5-tert-butylthiophen-2-yl)-5-oxo-1-[2-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Also Known As: A1497/0065643, 2-amino-4-(5-tert-butylthiophen-2-yl)-5-oxo-1-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, 2-Amino-4-(5-(tert-butyl)thiophen-2-yl)-5-oxo-1-(2-(trifluoromethyl)phenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, 2-AMINO-4-(5-TERT-BUTYL-2-THIENYL)-5-OXO-1-[2-(TRIFLUOROMETHYL)PHENYL]-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBONITRILE, 2-AMINO-4-(5-TERT-BUTYL-2-THIENYL)-5-OXO-1-(2-(TRIFLUOROMETHYL)PHENYL)-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBONITRILE
| Molecular Formula | C25H24F3N3OS |
|---|---|
| Molecular Weight | 471.16 g/mol |
| LogP | 6.36918 |
| Topological Polar Surface Area | 70.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 471.1592 |
| Heavy Atoms | 33 |
| Complexity | 1224.4974 |
Chemical Identifiers
| CAS Number | 311784-12-0 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=CC=C4C(F)(F)F)N)C#N |
Product Overview
A1497/0065643 (CAS 311784-12-0), with molecular formula C25H24F3N3OS and molecular weight 471.16 g/mol. IUPAC: 2-amino-4-(5-tert-butylthiophen-2-yl)-5-oxo-1-[2-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile.
Chemical Property Profile of A1497/0065643
Property Insights of A1497/0065643
The XLogP value of 6.36918 indicates that A1497/0065643 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.12 Ų falls within the moderate polarity range, balancing permeability and solubility for A1497/0065643. Following Lipinski's Rule of Five, A1497/0065643 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1497/0065643?
The CAS number of A1497/0065643 is 311784-12-0.
What is the molecular formula of A1497/0065643?
The molecular formula of A1497/0065643 is C25H24F3N3OS.
What is the molecular weight of A1497/0065643?
The molecular weight of A1497/0065643 is 471.16 g/mol.
Where can I buy A1497/0065643?
You can request a quote for A1497/0065643 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1497/0065643?
Yes, KEHONG BIO provides custom synthesis services for A1497/0065643 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.