BAS 02102224
TL;DR: BAS 02102224 (CAS 503591-50-2) is a chemical compound with molecular formula C30H31ClN2O7 and molecular weight 566.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopentyl 4-(4-chloro-3-nitrophenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 02102224, Cyclopentyl 4-(4-chloro-3-nitrophenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 4-(4-Chloro-3-nitro-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-(4-chloro-3-nitrophenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, Cyclopentyl4-(4-chloro-3-nitrophenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C30H31ClN2O7 |
|---|---|
| Molecular Weight | 566.18 g/mol |
| LogP | 6.1128 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 566.182 |
| Heavy Atoms | 40 |
| Complexity | 1441.5259 |
Chemical Identifiers
| CAS Number | 503591-50-2 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC(=C(C=C3)OC)OC)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C(=O)OC5CCCC5 |
Product Overview
BAS 02102224 (CAS 503591-50-2), with molecular formula C30H31ClN2O7 and molecular weight 566.18 g/mol. IUPAC: cyclopentyl 4-(4-chloro-3-nitrophenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 02102224
Property Insights of BAS 02102224
The XLogP value of 6.1128 indicates that BAS 02102224 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02102224. Following Lipinski's Rule of Five, BAS 02102224 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02102224?
The CAS number of BAS 02102224 is 503591-50-2.
What is the molecular formula of BAS 02102224?
The molecular formula of BAS 02102224 is C30H31ClN2O7.
What is the molecular weight of BAS 02102224?
The molecular weight of BAS 02102224 is 566.18 g/mol.
Where can I buy BAS 02102224?
You can request a quote for BAS 02102224 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02102224?
Yes, KEHONG BIO provides custom synthesis services for BAS 02102224 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.