BAS 01052105
TL;DR: BAS 01052105 (CAS 329073-32-7) is a chemical compound with molecular formula C29H32ClNO5 and molecular weight 509.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl 7-(4-chlorophenyl)-4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 01052105, 2-methylpropyl 7-(4-chlorophenyl)-4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2-methylpropyl 7-(4-chlorophenyl)-4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo- 1,4,6,7,8-pentahydroquinoline-3-carboxylate, 2-methylpropyl 7-(4-chlorophenyl)-4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, isobutyl 7-(4-chlorophenyl)-4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C29H32ClNO5 |
|---|---|
| Molecular Weight | 509.20 g/mol |
| LogP | 6.0051 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 509.1969 |
| Heavy Atoms | 36 |
| Complexity | 1228.7257 |
Chemical Identifiers
| CAS Number | 329073-32-7 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)Cl)NC(=C2C(=O)OCC(C)C)C)O |
Product Overview
BAS 01052105 (CAS 329073-32-7), with molecular formula C29H32ClNO5 and molecular weight 509.20 g/mol. IUPAC: 2-methylpropyl 7-(4-chlorophenyl)-4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 01052105
Property Insights of BAS 01052105
The XLogP value of 6.0051 indicates that BAS 01052105 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01052105. Following Lipinski's Rule of Five, BAS 01052105 has 2 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 01052105?
The CAS number of BAS 01052105 is 329073-32-7.
What is the molecular formula of BAS 01052105?
The molecular formula of BAS 01052105 is C29H32ClNO5.
What is the molecular weight of BAS 01052105?
The molecular weight of BAS 01052105 is 509.20 g/mol.
Where can I buy BAS 01052105?
You can request a quote for BAS 01052105 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01052105?
Yes, KEHONG BIO provides custom synthesis services for BAS 01052105 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.