BAS 01251595
TL;DR: BAS 01251595 (CAS 312526-58-2) is a chemical compound with molecular formula C27H27BrClNO3S and molecular weight 559.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylsulfanylethyl 4-(3-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 01251595, A1998/0083932, 2-(ethylsulfanyl)ethyl 4-(3-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2-(ethylsulfanyl)ethyl 4-(3-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, 2-ethylsulfanylethyl 4-(3-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C27H27BrClNO3S |
|---|---|
| Molecular Weight | 559.06 g/mol |
| LogP | 6.7604 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 559.05835 |
| Heavy Atoms | 34 |
| Complexity | 1158.7201 |
Chemical Identifiers
| CAS Number | 312526-58-2 |
|---|---|
| SMILES | CCSCCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)Br)C(=O)CC(C2)C4=CC=C(C=C4)Cl)C |
Product Overview
BAS 01251595 (CAS 312526-58-2), with molecular formula C27H27BrClNO3S and molecular weight 559.06 g/mol. IUPAC: 2-ethylsulfanylethyl 4-(3-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 01251595
Property Insights of BAS 01251595
The XLogP value of 6.7604 indicates that BAS 01251595 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 01251595 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01251595 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 BAS 01251595?
The CAS number of BAS 01251595 is 312526-58-2.
What is the molecular formula of BAS 01251595?
The molecular formula of BAS 01251595 is C27H27BrClNO3S.
What is the molecular weight of BAS 01251595?
The molecular weight of BAS 01251595 is 559.06 g/mol.
Where can I buy BAS 01251595?
You can request a quote for BAS 01251595 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01251595?
Yes, KEHONG BIO provides custom synthesis services for BAS 01251595 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.