Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester
TL;DR: Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester (CAS 89717-53-3) is a chemical compound with molecular formula C21H24N2O4 and molecular weight 368.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4,5-dibenzamidopentanoate
Also Known As: ethyl 4,5-dibenzamidopentanoate, Ethyl 4,5-bis(benzamido)pentanoate, ethyl 4,5-bis(benzoylamino)pentanoate, Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester
| Molecular Formula | C21H24N2O4 |
|---|---|
| Molecular Weight | 368.17 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 368.1736 |
| Heavy Atoms | 27 |
| Complexity | 483.0 |
Chemical Identifiers
| CAS Number | 89717-53-3 |
|---|---|
| SMILES | CCOC(=O)CCC(CNC(=O)C1=CC=CC=C1)NC(=O)C2=CC=CC=C2 |
| InChIKey | MKFOCHLOHPOFIS-UHFFFAOYSA-N |
Product Overview
Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester (CAS 89717-53-3), with molecular formula C21H24N2O4 and molecular weight 368.17 g/mol. IUPAC: ethyl 4,5-dibenzamidopentanoate.
Chemical Property Profile of Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester
Property Insights of Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester. Following Lipinski's Rule of Five, Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester?
The CAS number of Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester is 89717-53-3.
What is the molecular formula of Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester?
The molecular formula of Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester is C21H24N2O4.
What is the molecular weight of Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester?
The molecular weight of Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester is 368.17 g/mol.
Where can I buy Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester?
You can request a quote for Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Pentanoic acid, 4,5-bis(benzoylamino)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.