BAS 00915339
TL;DR: BAS 00915339 (CAS 313244-86-9) is a chemical compound with molecular formula C25H24ClNO3 and molecular weight 421.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenylethyl 4-(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 00915339, BIM-0032346.P001, 2-phenylethyl 4-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 4-(4-Chloro-phenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-quinoline-3-carboxylic, phenethyl 4-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C25H24ClNO3 |
|---|---|
| Molecular Weight | 421.14 g/mol |
| LogP | 5.0938 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.14447 |
| Heavy Atoms | 30 |
| Complexity | 1022.1191 |
Chemical Identifiers
| CAS Number | 313244-86-9 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)Cl)C(=O)OCCC4=CC=CC=C4 |
Product Overview
BAS 00915339 (CAS 313244-86-9), with molecular formula C25H24ClNO3 and molecular weight 421.14 g/mol. IUPAC: 2-phenylethyl 4-(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 00915339
Property Insights of BAS 00915339
The XLogP value of 5.0938 indicates that BAS 00915339 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, BAS 00915339 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00915339 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00915339?
The CAS number of BAS 00915339 is 313244-86-9.
What is the molecular formula of BAS 00915339?
The molecular formula of BAS 00915339 is C25H24ClNO3.
What is the molecular weight of BAS 00915339?
The molecular weight of BAS 00915339 is 421.14 g/mol.
Where can I buy BAS 00915339?
You can request a quote for BAS 00915339 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00915339?
Yes, KEHONG BIO provides custom synthesis services for BAS 00915339 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.