2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate
TL;DR: 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate (CAS 680618-27-3) is a chemical compound with molecular formula C14H13ClN2O4S and molecular weight 340.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate
Also Known As: 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate, 2-(Pyridin-2-yl)ethyl (4-(chlorosulfonyl)phenyl)carbamate, (4-Chlorosulfonyl-phenyl)-carbamic acid 2-pyridin-2-yl-ethyl ester, (4-chlorosulfonylphenyl)carbamic acid 2-pyridin-2-yl-ethyl ester, 2-(2-pyridyl)ethyl N-(4-chlorosulfonylphenyl)carbamate
| Molecular Formula | C14H13ClN2O4S |
|---|---|
| Molecular Weight | 340.03 g/mol |
| LogP | 2.8003 |
| Topological Polar Surface Area | 85.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 340.02844 |
| Heavy Atoms | 22 |
| Complexity | 733.198 |
Chemical Identifiers
| CAS Number | 680618-27-3 |
|---|---|
| SMILES | C1=CC=NC(=C1)CCOC(=O)NC2=CC=C(C=C2)S(=O)(=O)Cl |
Product Overview
2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate (CAS 680618-27-3), with molecular formula C14H13ClN2O4S and molecular weight 340.03 g/mol. IUPAC: 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate.
Chemical Property Profile of 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate
Property Insights of 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate
The XLogP value of 2.8003 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate. The TPSA of 85.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate. Following Lipinski's Rule of Five, 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate has 1 hydrogen bond donor(s) and 5 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 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate?
The CAS number of 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate is 680618-27-3.
What is the molecular formula of 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate?
The molecular formula of 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate is C14H13ClN2O4S.
What is the molecular weight of 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate?
The molecular weight of 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate is 340.03 g/mol.
Where can I buy 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate?
You can request a quote for 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for 2-pyridin-2-ylethyl N-(4-chlorosulfonylphenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.