BAS 01251536
TL;DR: BAS 01251536 (CAS 330208-91-8) is a chemical compound with molecular formula C29H29BrClNO3 and molecular weight 553.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexyl 4-(3-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 01251536, cyclohexyl 4-(3-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, cyclohexyl 4-(3-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,6,7,8-penta hydroquinoline-3-carboxylate, cyclohexyl 4-(3-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C29H29BrClNO3 |
|---|---|
| Molecular Weight | 553.10 g/mol |
| LogP | 7.34 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 553.1019 |
| Heavy Atoms | 35 |
| Complexity | 1210.6876 |
Chemical Identifiers
| CAS Number | 330208-91-8 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)Br)C(=O)OC5CCCCC5 |
Product Overview
BAS 01251536 (CAS 330208-91-8), with molecular formula C29H29BrClNO3 and molecular weight 553.10 g/mol. IUPAC: cyclohexyl 4-(3-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 01251536
Property Insights of BAS 01251536
The XLogP value of 7.34 indicates that BAS 01251536 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 01251536 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01251536 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 01251536?
The CAS number of BAS 01251536 is 330208-91-8.
What is the molecular formula of BAS 01251536?
The molecular formula of BAS 01251536 is C29H29BrClNO3.
What is the molecular weight of BAS 01251536?
The molecular weight of BAS 01251536 is 553.10 g/mol.
Where can I buy BAS 01251536?
You can request a quote for BAS 01251536 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01251536?
Yes, KEHONG BIO provides custom synthesis services for BAS 01251536 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.