A1735/0073736
TL;DR: A1735/0073736 (CAS 312275-80-2) is a chemical compound with molecular formula C25H22F3N3O2 and molecular weight 453.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(4-ethoxyphenyl)-5-oxo-1-[3-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Also Known As: A1735/0073736, 2-Amino-4-(4-ethoxyphenyl)-5-oxo-1-(3-(trifluoromethyl)phenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, 2-amino-4-(4-ethoxyphenyl)-5-oxo-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, 2-amino-4-(4-ethoxyphenyl)-5-oxo-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile, 2-AMINO-4-(4-ETHOXYPHENYL)-5-OXO-1-(3-(TRIFLUOROMETHYL)PHENYL)-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBONITRILE
| Molecular Formula | C25H22F3N3O2 |
|---|---|
| Molecular Weight | 453.17 g/mol |
| LogP | 5.40888 |
| Topological Polar Surface Area | 79.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 453.1664 |
| Heavy Atoms | 33 |
| Complexity | 1190.6133 |
Chemical Identifiers
| CAS Number | 312275-80-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=CC(=C4)C(F)(F)F)N)C#N |
Product Overview
A1735/0073736 (CAS 312275-80-2), with molecular formula C25H22F3N3O2 and molecular weight 453.17 g/mol. IUPAC: 2-amino-4-(4-ethoxyphenyl)-5-oxo-1-[3-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile.
Chemical Property Profile of A1735/0073736
Property Insights of A1735/0073736
The XLogP value of 5.40888 indicates that A1735/0073736 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.35 Ų falls within the moderate polarity range, balancing permeability and solubility for A1735/0073736. Following Lipinski's Rule of Five, A1735/0073736 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 A1735/0073736?
The CAS number of A1735/0073736 is 312275-80-2.
What is the molecular formula of A1735/0073736?
The molecular formula of A1735/0073736 is C25H22F3N3O2.
What is the molecular weight of A1735/0073736?
The molecular weight of A1735/0073736 is 453.17 g/mol.
Where can I buy A1735/0073736?
You can request a quote for A1735/0073736 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1735/0073736?
Yes, KEHONG BIO provides custom synthesis services for A1735/0073736 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.