Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester
TL;DR: Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester (CAS 160790-07-8) is a chemical compound with molecular formula C13H15BrO4S and molecular weight 345.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-(4-bromophenyl)sulfonylcyclopentane-1-carboxylate
Also Known As: Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester, methyl 1-(4-bromophenyl)sulfonylcyclopentane-1-carboxylate, BIM-0027054.P001, methyl 1-[(4-bromophenyl)sulfonyl]cyclopentanecarboxylate, Methyl 1-(4-bromobenzene-1-sulfonyl)cyclopentane-1-carboxylate
| Molecular Formula | C13H15BrO4S |
|---|---|
| Molecular Weight | 345.99 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 68.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.98743 |
| Heavy Atoms | 19 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 160790-07-8 |
|---|---|
| SMILES | COC(=O)C1(CCCC1)S(=O)(=O)C2=CC=C(C=C2)Br |
| InChIKey | GTCWZRDSJBFIDT-UHFFFAOYSA-N |
Product Overview
Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester (CAS 160790-07-8), with molecular formula C13H15BrO4S and molecular weight 345.99 g/mol. IUPAC: methyl 1-(4-bromophenyl)sulfonylcyclopentane-1-carboxylate.
Chemical Property Profile of Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester
Property Insights of Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester. The TPSA of 68.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester. Following Lipinski's Rule of Five, Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester has 0 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 Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester?
The CAS number of Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester is 160790-07-8.
What is the molecular formula of Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester?
The molecular formula of Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester is C13H15BrO4S.
What is the molecular weight of Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester?
The molecular weight of Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester is 345.99 g/mol.
Where can I buy Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester?
You can request a quote for Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Cyclopentanecarboxylic acid, 1-((4-bromophenyl)sulfonyl)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.