3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid
TL;DR: 3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid (CAS 294647-10-2) is a chemical compound with molecular formula C17H23NO3 and molecular weight 289.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(benzylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid
Also Known As: 3-(benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid, 3-(benzylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid, 1,2,2-trimethyl-3-[N-benzylcarbamoyl]cyclopentanecarboxylic acid, 3-[(benzylamino)carbonyl]-1,2,2-trimethylcyclopentanecarboxylic acid
| Molecular Formula | C17H23NO3 |
|---|---|
| Molecular Weight | 289.17 g/mol |
| LogP | 2.8299 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.1678 |
| Heavy Atoms | 21 |
| Complexity | 538.226 |
Chemical Identifiers
| CAS Number | 294647-10-2 |
|---|---|
| SMILES | CC1(C(CCC1(C)C(=O)O)C(=O)NCC2=CC=CC=C2)C |
Product Overview
3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid (CAS 294647-10-2), with molecular formula C17H23NO3 and molecular weight 289.17 g/mol. IUPAC: 3-(benzylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid.
Chemical Property Profile of 3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid
Property Insights of 3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid
The XLogP value of 2.8299 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid. Following Lipinski's Rule of Five, 3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid has 2 hydrogen bond donor(s) and 2 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 3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid?
The CAS number of 3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid is 294647-10-2.
What is the molecular formula of 3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid?
The molecular formula of 3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid is C17H23NO3.
What is the molecular weight of 3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid?
The molecular weight of 3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid is 289.17 g/mol.
Where can I buy 3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid?
You can request a quote for 3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(Benzylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.