AB00094334-01
TL;DR: AB00094334-01 (CAS 329072-00-6) is a chemical compound with molecular formula C25H24FNO4 and molecular weight 421.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methoxyphenyl)methyl 4-(3-fluorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: AB00094334-01, 4-methoxybenzyl 4-(3-fluorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, (4-METHOXYPHENYL)METHYL 4-(3-FLUOROPHENYL)-2-METHYL-5-OXO-1,4,5,6,7,8-HEXAHYDROQUINOLINE-3-CARBOXYLATE, (4-methoxyphenyl)methyl 4-(3-fluorophenyl)-2-methyl-5-oxo-1,4,6,7,8-pentahydro quinoline-3-carboxylate, (4-methoxyphenyl)methyl 4-(3-fluorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C25H24FNO4 |
|---|---|
| Molecular Weight | 421.17 g/mol |
| LogP | 4.5456 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.16895 |
| Heavy Atoms | 31 |
| Complexity | 1084.9558 |
Chemical Identifiers
| CAS Number | 329072-00-6 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=CC=C3)F)C(=O)OCC4=CC=C(C=C4)OC |
Product Overview
AB00094334-01 (CAS 329072-00-6), with molecular formula C25H24FNO4 and molecular weight 421.17 g/mol. IUPAC: (4-methoxyphenyl)methyl 4-(3-fluorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of AB00094334-01
Property Insights of AB00094334-01
The XLogP value of 4.5456 indicates that AB00094334-01 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 AB00094334-01. Following Lipinski's Rule of Five, AB00094334-01 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 AB00094334-01?
The CAS number of AB00094334-01 is 329072-00-6.
What is the molecular formula of AB00094334-01?
The molecular formula of AB00094334-01 is C25H24FNO4.
What is the molecular weight of AB00094334-01?
The molecular weight of AB00094334-01 is 421.17 g/mol.
Where can I buy AB00094334-01?
You can request a quote for AB00094334-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00094334-01?
Yes, KEHONG BIO provides custom synthesis services for AB00094334-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.