BAS 02102223
TL;DR: BAS 02102223 (CAS 333308-80-8) is a chemical compound with molecular formula C30H31ClFNO5 and molecular weight 539.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopentyl 4-(2-chloro-6-fluorophenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 02102223, Cyclopentyl 4-(2-chloro-6-fluorophenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 4-(2-Chloro-6-fluoro-phenyl)-7-(3,4-dimethoxy-phenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-quinoline-3-carboxylic acid cyclopentyl ester, cyclopentyl 4-(2-chloro-6-fluorophenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, Cyclopentyl4-(2-chloro-6-fluorophenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C30H31ClFNO5 |
|---|---|
| Molecular Weight | 539.19 g/mol |
| LogP | 6.3437 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 539.1875 |
| Heavy Atoms | 38 |
| Complexity | 1323.8987 |
Chemical Identifiers
| CAS Number | 333308-80-8 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC(=C(C=C3)OC)OC)C4=C(C=CC=C4Cl)F)C(=O)OC5CCCC5 |
Product Overview
BAS 02102223 (CAS 333308-80-8), with molecular formula C30H31ClFNO5 and molecular weight 539.19 g/mol. IUPAC: cyclopentyl 4-(2-chloro-6-fluorophenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 02102223
Property Insights of BAS 02102223
The XLogP value of 6.3437 indicates that BAS 02102223 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 02102223. Following Lipinski's Rule of Five, BAS 02102223 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 02102223?
The CAS number of BAS 02102223 is 333308-80-8.
What is the molecular formula of BAS 02102223?
The molecular formula of BAS 02102223 is C30H31ClFNO5.
What is the molecular weight of BAS 02102223?
The molecular weight of BAS 02102223 is 539.19 g/mol.
Where can I buy BAS 02102223?
You can request a quote for BAS 02102223 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02102223?
Yes, KEHONG BIO provides custom synthesis services for BAS 02102223 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.