Candoxatril
TL;DR: Candoxatril (CAS 118785-03-8) is a chemical compound with molecular formula C29H41NO7 and molecular weight 515.2883 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[[1-[3-(2,3-dihydro-1H-inden-5-yloxy)-2-(2-methoxyethoxymethyl)-3-oxopropyl]cyclopentanecarbonyl]amino]cyclohexane-1-carboxylic acid
Also Known As: Candoxatril, UK 79300, J1.368.042F, 3-(1-((4-Carboxycyclohexyl)carbamoyl)cyclopentyl)-2-(2-methoxyethoxymethyl)propanoic acid 5-indanyl ester, 4-[[1-[3-(2,3-dihydro-1H-inden-5-yloxy)-2-(2-methoxyethoxymethyl)-3-oxopropyl]cyclopentanecarbonyl]amino]cyclohexane-1-carboxylic acid
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C29H41NO7 |
| Molecular Weight | 515.2883 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 13 |
| Exact Mass | 515.2883 Da |
| Heavy Atoms | 37 |
| Complexity | 772.0 |
| SMILES | COCCOCC(CC1(CCCC1)C(=O)NC2CCC(CC2)C(=O)O)C(=O)OC3=CC4=C(CCC4)C=C3 |
| InChIKey | ZTWZVMIYIIVABD-UHFFFAOYSA-N |
Chemical Property Profile of Candoxatril
Property Insights of Candoxatril
The XLogP value of 4.0 indicates that Candoxatril is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Candoxatril. Following Lipinski's Rule of Five, Candoxatril has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Candoxatril?
The CAS number of Candoxatril is 118785-03-8.
What is the molecular formula of Candoxatril?
The molecular formula of Candoxatril is C29H41NO7.
What is the molecular weight of Candoxatril?
The molecular weight of Candoxatril is 515.2883 g/mol.
Where can I buy Candoxatril?
You can request a quote for Candoxatril directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Candoxatril?
Yes, CoreyChem provides custom synthesis services for Candoxatril and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.