Cyclopyrimorate
TL;DR: Cyclopyrimorate (CAS 499231-24-2) is a chemical compound with molecular formula C29H32N2O7 and molecular weight 520.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 7-(3,4-dimethoxyphenyl)-2-methyl-4-(4-nitrophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: Cyclopyrimorate, BAS 01885360, Butyl 7-(3,4-dimethoxyphenyl)-2-methyl-4-(4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 7-(3,4-Dimethoxy-phenyl)-2-methyl-4-(4-nitro-phenyl)-5-oxo-1,4,5,6,7,8-hexahydro-quinoline-3-carboxylic acid butyl ester, butyl 7-(3,4-dimethoxyphenyl)-2-methyl-4-(4-nitrophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C29H32N2O7 |
|---|---|
| Molecular Weight | 520.22 g/mol |
| LogP | 5.3169 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 520.22095 |
| Heavy Atoms | 38 |
| Complexity | 1310.7068 |
Chemical Identifiers
| CAS Number | 499231-24-2 |
|---|---|
| SMILES | CCCCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)[N+](=O)[O-])C(=O)CC(C2)C4=CC(=C(C=C4)OC)OC)C |
Product Overview
Cyclopyrimorate (CAS 499231-24-2), with molecular formula C29H32N2O7 and molecular weight 520.22 g/mol. IUPAC: butyl 7-(3,4-dimethoxyphenyl)-2-methyl-4-(4-nitrophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of Cyclopyrimorate
Property Insights of Cyclopyrimorate
The XLogP value of 5.3169 indicates that Cyclopyrimorate 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 Cyclopyrimorate. Following Lipinski's Rule of Five, Cyclopyrimorate 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 Cyclopyrimorate?
The CAS number of Cyclopyrimorate is 499231-24-2.
What is the molecular formula of Cyclopyrimorate?
The molecular formula of Cyclopyrimorate is C29H32N2O7.
What is the molecular weight of Cyclopyrimorate?
The molecular weight of Cyclopyrimorate is 520.22 g/mol.
Where can I buy Cyclopyrimorate?
You can request a quote for Cyclopyrimorate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopyrimorate?
Yes, KEHONG BIO provides custom synthesis services for Cyclopyrimorate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.