BAS 01404447
TL;DR: BAS 01404447 (CAS 312596-94-4) is a chemical compound with molecular formula C29H30ClNO4 and molecular weight 491.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopentyl 4-(4-chlorophenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 01404447, cyclopentyl 4-(4-chlorophenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, cyclopentyl 4-(4-chlorophenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,6,7,8-pe ntahydroquinoline-3-carboxylate, cyclopentyl 4-(4-chlorophenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C29H30ClNO4 |
|---|---|
| Molecular Weight | 491.19 g/mol |
| LogP | 6.196 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 491.18634 |
| Heavy Atoms | 35 |
| Complexity | 1190.1925 |
Chemical Identifiers
| CAS Number | 312596-94-4 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)Cl)C(=O)OC5CCCC5 |
Product Overview
BAS 01404447 (CAS 312596-94-4), with molecular formula C29H30ClNO4 and molecular weight 491.19 g/mol. IUPAC: cyclopentyl 4-(4-chlorophenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 01404447
Property Insights of BAS 01404447
The XLogP value of 6.196 indicates that BAS 01404447 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01404447. Following Lipinski's Rule of Five, BAS 01404447 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01404447?
The CAS number of BAS 01404447 is 312596-94-4.
What is the molecular formula of BAS 01404447?
The molecular formula of BAS 01404447 is C29H30ClNO4.
What is the molecular weight of BAS 01404447?
The molecular weight of BAS 01404447 is 491.19 g/mol.
Where can I buy BAS 01404447?
You can request a quote for BAS 01404447 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01404447?
Yes, KEHONG BIO provides custom synthesis services for BAS 01404447 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.