Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate
TL;DR: Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate (CAS 313231-91-3) is a chemical compound with molecular formula C17H21Cl2NO3 and molecular weight 357.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(2,4-dichlorophenyl)carbamoyl]-1,2,2-trimethylcyclopentane-1-carboxylate
Also Known As: BAS 00293804, methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate, methyl 3-[(2,4-dichlorophenyl)carbamoyl]-1,2,2-trimethylcyclopentane-1-carboxylate, methyl 3-[(2,4-dichlorophenyl)carbamoyl]-1,2,2-trimethylcyclopentanecarboxylate
| Molecular Formula | C17H21Cl2NO3 |
|---|---|
| Molecular Weight | 357.09 g/mol |
| LogP | 4.5474 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.08984 |
| Heavy Atoms | 23 |
| Complexity | 644.7257 |
Chemical Identifiers
| CAS Number | 313231-91-3 |
|---|---|
| SMILES | CC1(C(CCC1(C)C(=O)OC)C(=O)NC2=C(C=C(C=C2)Cl)Cl)C |
Product Overview
Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate (CAS 313231-91-3), with molecular formula C17H21Cl2NO3 and molecular weight 357.09 g/mol. IUPAC: methyl 3-[(2,4-dichlorophenyl)carbamoyl]-1,2,2-trimethylcyclopentane-1-carboxylate.
Chemical Property Profile of Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate
Property Insights of Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate
The XLogP value of 4.5474 indicates that Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate has 1 hydrogen bond donor(s) and 3 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 Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate?
The CAS number of Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate is 313231-91-3.
What is the molecular formula of Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate?
The molecular formula of Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate is C17H21Cl2NO3.
What is the molecular weight of Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate?
The molecular weight of Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate is 357.09 g/mol.
Where can I buy Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate?
You can request a quote for Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-((2,4-dichlorophenyl)carbamoyl)-1,2,2-trimethylcyclopentanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.