BAS 01404502
TL;DR: BAS 01404502 (CAS 337927-59-0) is a chemical compound with molecular formula C24H22ClNO4 and molecular weight 423.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 7-(4-chlorophenyl)-4-(3-hydroxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 01404502, AB00094671-01, methyl 7-(4-chlorophenyl)-4-(3-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, methyl 7-(4-chlorophenyl)-4-(3-hydroxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, methyl 7-(4-chlorophenyl)-4-(3-hydroxyphenyl)-2-methyl-5-oxo-1,4,6,7,8-pentahy droquinoline-3-carboxylate
| Molecular Formula | C24H22ClNO4 |
|---|---|
| Molecular Weight | 423.12 g/mol |
| LogP | 4.5802 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 423.12375 |
| Heavy Atoms | 30 |
| Complexity | 1084.6396 |
Chemical Identifiers
| CAS Number | 337927-59-0 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)O)C(=O)OC |
Product Overview
BAS 01404502 (CAS 337927-59-0), with molecular formula C24H22ClNO4 and molecular weight 423.12 g/mol. IUPAC: methyl 7-(4-chlorophenyl)-4-(3-hydroxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 01404502
Property Insights of BAS 01404502
The XLogP value of 4.5802 indicates that BAS 01404502 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01404502. Following Lipinski's Rule of Five, BAS 01404502 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 01404502?
The CAS number of BAS 01404502 is 337927-59-0.
What is the molecular formula of BAS 01404502?
The molecular formula of BAS 01404502 is C24H22ClNO4.
What is the molecular weight of BAS 01404502?
The molecular weight of BAS 01404502 is 423.12 g/mol.
Where can I buy BAS 01404502?
You can request a quote for BAS 01404502 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01404502?
Yes, KEHONG BIO provides custom synthesis services for BAS 01404502 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.