3-Nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride
TL;DR: 3-Nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride (CAS 331256-60-1) is a chemical compound with molecular formula C10H9ClN2O5S and molecular weight 303.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride
Also Known As: 3-nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride, BAS 00360560, 3-Nitro-4-(2-oxopyrrolidin-1-yl)benzene-1-sulfonyl chloride, 3-Nitro-4-(2-oxopyrrolidin-1-yl)-benzenesulfonyl chloride, 3-Nitro-4-(2-oxo-pyrrolidin-1-yl)-benzenesulfonyl chloride
| Molecular Formula | C10H9ClN2O5S |
|---|---|
| Molecular Weight | 303.99 g/mol |
| LogP | 1.6491 |
| Topological Polar Surface Area | 97.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 303.99207 |
| Heavy Atoms | 19 |
| Complexity | 657.8839 |
Chemical Identifiers
| CAS Number | 331256-60-1 |
|---|---|
| SMILES | C1CC(=O)N(C1)C2=C(C=C(C=C2)S(=O)(=O)Cl)[N+](=O)[O-] |
Product Overview
3-Nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride (CAS 331256-60-1), with molecular formula C10H9ClN2O5S and molecular weight 303.99 g/mol. IUPAC: 3-nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride.
Chemical Property Profile of 3-Nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride
Property Insights of 3-Nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride
The XLogP value of 1.6491 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride. The TPSA of 97.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride. Following Lipinski's Rule of Five, 3-Nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride has 0 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 3-Nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride?
The CAS number of 3-Nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride is 331256-60-1.
What is the molecular formula of 3-Nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride?
The molecular formula of 3-Nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride is C10H9ClN2O5S.
What is the molecular weight of 3-Nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride?
The molecular weight of 3-Nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride is 303.99 g/mol.
Where can I buy 3-Nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride?
You can request a quote for 3-Nitro-4-(2-oxopyrrolidin-1-yl)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-Nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.