BAS 01052158
TL;DR: BAS 01052158 (CAS 354818-27-2) is a chemical compound with molecular formula C29H32BrNO5 and molecular weight 553.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butan-2-yl 4-(2-bromo-4,5-dimethoxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 01052158, butan-2-yl 4-(2-bromo-4,5-dimethoxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, butan-2-yl 4-(2-bromo-4,5-dimethoxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, sec-butyl 4-(2-bromo-4,5-dimethoxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, methylpropyl 4-(2-bromo-4,5-dimethoxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,6,7,8 -pentahydroquinoline-3-carboxylate
| Molecular Formula | C29H32BrNO5 |
|---|---|
| Molecular Weight | 553.15 g/mol |
| LogP | 6.1696 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 553.14636 |
| Heavy Atoms | 36 |
| Complexity | 1233.7257 |
Chemical Identifiers
| CAS Number | 354818-27-2 |
|---|---|
| SMILES | CCC(C)OC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3Br)OC)OC)C(=O)CC(C2)C4=CC=CC=C4)C |
Product Overview
BAS 01052158 (CAS 354818-27-2), with molecular formula C29H32BrNO5 and molecular weight 553.15 g/mol. IUPAC: butan-2-yl 4-(2-bromo-4,5-dimethoxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 01052158
Property Insights of BAS 01052158
The XLogP value of 6.1696 indicates that BAS 01052158 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01052158. Following Lipinski's Rule of Five, BAS 01052158 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01052158?
The CAS number of BAS 01052158 is 354818-27-2.
What is the molecular formula of BAS 01052158?
The molecular formula of BAS 01052158 is C29H32BrNO5.
What is the molecular weight of BAS 01052158?
The molecular weight of BAS 01052158 is 553.15 g/mol.
Where can I buy BAS 01052158?
You can request a quote for BAS 01052158 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01052158?
Yes, KEHONG BIO provides custom synthesis services for BAS 01052158 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.