3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride
TL;DR: 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride (CAS 678185-86-9) is a chemical compound with molecular formula C11H12Cl2N2O3S and molecular weight 321.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl chloride
Also Known As: 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride, 3-Chloro-4-(pyrrolidine-1-carboxamido)benzene-1-sulfonyl chloride, 3-Chloro-4-[(pyrrolidine-1-carbonyl)-amino]-benzenesulfonyl chloride, 3-Chloro-4-(pyrrolidine-1-carboxamido)benzene-1-sulfonylchloride, 3-chloro-4-[(pyrrolidine-1-carbonyl)-amino]benzenesulfonyl chloride
| Molecular Formula | C11H12Cl2N2O3S |
|---|---|
| Molecular Weight | 321.99 g/mol |
| LogP | 2.8952 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 321.99457 |
| Heavy Atoms | 19 |
| Complexity | 597.9579 |
Chemical Identifiers
| CAS Number | 678185-86-9 |
|---|---|
| SMILES | C1CCN(C1)C(=O)NC2=C(C=C(C=C2)S(=O)(=O)Cl)Cl |
Product Overview
3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride (CAS 678185-86-9), with molecular formula C11H12Cl2N2O3S and molecular weight 321.99 g/mol. IUPAC: 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl chloride.
Chemical Property Profile of 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride
Property Insights of 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride
The XLogP value of 2.8952 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride. Following Lipinski's Rule of Five, 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride 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 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride?
The CAS number of 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride is 678185-86-9.
What is the molecular formula of 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride?
The molecular formula of 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride is C11H12Cl2N2O3S.
What is the molecular weight of 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride?
The molecular weight of 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride is 321.99 g/mol.
Where can I buy 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride?
You can request a quote for 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-4-(pyrrolidine-1-carbonylamino)benzenesulfonyl Chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.