BAS 01052148
TL;DR: BAS 01052148 (CAS 329073-47-4) is a chemical compound with molecular formula C21H24ClNO3S and molecular weight 405.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylsulfanylethyl 4-(3-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 01052148, AB00094300-01, 2-(ethylsulfanyl)ethyl 4-(3-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2-(ethylsulfanyl)ethyl 4-(3-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, 2-ethylsulfanylethyl 4-(3-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C21H24ClNO3S |
|---|---|
| Molecular Weight | 405.12 g/mol |
| LogP | 4.6042 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 405.11655 |
| Heavy Atoms | 27 |
| Complexity | 815.39966 |
Chemical Identifiers
| CAS Number | 329073-47-4 |
|---|---|
| SMILES | CCSCCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)Cl)C(=O)CCC2)C |
Product Overview
BAS 01052148 (CAS 329073-47-4), with molecular formula C21H24ClNO3S and molecular weight 405.12 g/mol. IUPAC: 2-ethylsulfanylethyl 4-(3-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 01052148
Property Insights of BAS 01052148
The XLogP value of 4.6042 indicates that BAS 01052148 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 01052148 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01052148 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 BAS 01052148?
The CAS number of BAS 01052148 is 329073-47-4.
What is the molecular formula of BAS 01052148?
The molecular formula of BAS 01052148 is C21H24ClNO3S.
What is the molecular weight of BAS 01052148?
The molecular weight of BAS 01052148 is 405.12 g/mol.
Where can I buy BAS 01052148?
You can request a quote for BAS 01052148 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01052148?
Yes, KEHONG BIO provides custom synthesis services for BAS 01052148 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.