BAS 01404433
TL;DR: BAS 01404433 (CAS 312596-83-1) is a chemical compound with molecular formula C26H25BrClNO3 and molecular weight 513.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-(4-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 01404433, BIM-0029290.P001, propan-2-yl 4-(4-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, isopropyl 4-(4-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, methylethyl 4-(4-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,6,7,8-pent ahydroquinoline-3-carboxylate
| Molecular Formula | C26H25BrClNO3 |
|---|---|
| Molecular Weight | 513.07 g/mol |
| LogP | 6.4157 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 513.0706 |
| Heavy Atoms | 32 |
| Complexity | 1116.7659 |
Chemical Identifiers
| CAS Number | 312596-83-1 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Br)C(=O)OC(C)C |
Product Overview
BAS 01404433 (CAS 312596-83-1), with molecular formula C26H25BrClNO3 and molecular weight 513.07 g/mol. IUPAC: propan-2-yl 4-(4-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 01404433
Property Insights of BAS 01404433
The XLogP value of 6.4157 indicates that BAS 01404433 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 01404433 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01404433 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 01404433?
The CAS number of BAS 01404433 is 312596-83-1.
What is the molecular formula of BAS 01404433?
The molecular formula of BAS 01404433 is C26H25BrClNO3.
What is the molecular weight of BAS 01404433?
The molecular weight of BAS 01404433 is 513.07 g/mol.
Where can I buy BAS 01404433?
You can request a quote for BAS 01404433 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01404433?
Yes, KEHONG BIO provides custom synthesis services for BAS 01404433 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.