Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester
TL;DR: Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester (CAS 17822-59-2) is a chemical compound with molecular formula C22H27NO3 and molecular weight 353.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[cyclopentyl(methyl)amino]ethyl 2-hydroxy-2,2-diphenylacetate
Also Known As: 2-(Cyclopentylmethylamino)ethyl benzilate, Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester, Benzilic acid 2-(methylcyclopentylamino)ethyl ester, 2-[cyclopentyl(methyl)amino]ethyl 2-hydroxy-2,2-diphenylacetate, 2-[Cyclopentyl(methyl)amino]ethyl hydroxydi(phenyl)acetate
| Molecular Formula | C22H27NO3 |
|---|---|
| Molecular Weight | 353.20 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 353.1991 |
| Heavy Atoms | 26 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 17822-59-2 |
|---|---|
| SMILES | CN(CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O)C3CCCC3 |
| InChIKey | NYJXQBWDAHRYQB-UHFFFAOYSA-N |
Product Overview
Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester (CAS 17822-59-2), with molecular formula C22H27NO3 and molecular weight 353.20 g/mol. IUPAC: 2-[cyclopentyl(methyl)amino]ethyl 2-hydroxy-2,2-diphenylacetate.
Chemical Property Profile of Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester
Property Insights of Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester
The XLogP value of 3.9 indicates that Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester has 1 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 Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester?
The CAS number of Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester is 17822-59-2.
What is the molecular formula of Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester?
The molecular formula of Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester is C22H27NO3.
What is the molecular weight of Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester?
The molecular weight of Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester is 353.20 g/mol.
Where can I buy Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester?
You can request a quote for Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.