A2552/0108653
TL;DR: A2552/0108653 (CAS 347315-00-8) is a chemical compound with molecular formula C26H24F3NO4 and molecular weight 471.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methoxyphenyl)methyl 2-methyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: A2552/0108653, 4-methoxybenzyl 2-methyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, (4-METHOXYPHENYL)METHYL 2-METHYL-5-OXO-4-[4-(TRIFLUOROMETHYL)PHENYL]-1,4,5,6,7,8-HEXAHYDROQUINOLINE-3-CARBOXYLATE, (4-methoxyphenyl)methyl 2-methyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-1,4,6,7,8 -pentahydroquinoline-3-carboxylate, (4-methoxyphenyl)methyl 2-methyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C26H24F3NO4 |
|---|---|
| Molecular Weight | 471.17 g/mol |
| LogP | 5.4253 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 471.16574 |
| Heavy Atoms | 34 |
| Complexity | 1162.0271 |
Chemical Identifiers
| CAS Number | 347315-00-8 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)C(F)(F)F)C(=O)OCC4=CC=C(C=C4)OC |
Product Overview
A2552/0108653 (CAS 347315-00-8), with molecular formula C26H24F3NO4 and molecular weight 471.17 g/mol. IUPAC: (4-methoxyphenyl)methyl 2-methyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of A2552/0108653
Property Insights of A2552/0108653
The XLogP value of 5.4253 indicates that A2552/0108653 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for A2552/0108653. Following Lipinski's Rule of Five, A2552/0108653 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 A2552/0108653?
The CAS number of A2552/0108653 is 347315-00-8.
What is the molecular formula of A2552/0108653?
The molecular formula of A2552/0108653 is C26H24F3NO4.
What is the molecular weight of A2552/0108653?
The molecular weight of A2552/0108653 is 471.17 g/mol.
Where can I buy A2552/0108653?
You can request a quote for A2552/0108653 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2552/0108653?
Yes, KEHONG BIO provides custom synthesis services for A2552/0108653 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.