BAS 01404406
TL;DR: BAS 01404406 (CAS 312596-08-0) is a chemical compound with molecular formula C30H32ClNO5 and molecular weight 521.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopentyl 7-(4-chlorophenyl)-4-(2,3-dimethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 01404406, cyclopentyl 7-(4-chlorophenyl)-4-(2,3-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, cyclopentyl 7-(4-chlorophenyl)-4-(2,3-dimethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, cyclopentyl 4-(2,3-dimethoxyphenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,6,7, 8-pentahydroquinoline-3-carboxylate
| Molecular Formula | C30H32ClNO5 |
|---|---|
| Molecular Weight | 521.20 g/mol |
| LogP | 6.2046 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 521.1969 |
| Heavy Atoms | 37 |
| Complexity | 1273.377 |
Chemical Identifiers
| CAS Number | 312596-08-0 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=C(C(=CC=C4)OC)OC)C(=O)OC5CCCC5 |
Product Overview
BAS 01404406 (CAS 312596-08-0), with molecular formula C30H32ClNO5 and molecular weight 521.20 g/mol. IUPAC: cyclopentyl 7-(4-chlorophenyl)-4-(2,3-dimethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 01404406
Property Insights of BAS 01404406
The XLogP value of 6.2046 indicates that BAS 01404406 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 01404406. Following Lipinski's Rule of Five, BAS 01404406 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 01404406?
The CAS number of BAS 01404406 is 312596-08-0.
What is the molecular formula of BAS 01404406?
The molecular formula of BAS 01404406 is C30H32ClNO5.
What is the molecular weight of BAS 01404406?
The molecular weight of BAS 01404406 is 521.20 g/mol.
Where can I buy BAS 01404406?
You can request a quote for BAS 01404406 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01404406?
Yes, KEHONG BIO provides custom synthesis services for BAS 01404406 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.