2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide
TL;DR: 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide (CAS 61072-86-4) is a chemical compound with molecular formula C12H8Cl2N2O4S and molecular weight 345.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide
Also Known As: 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide, BIM-0015680.P001, Benzenesulfonamide, 2,5-dichloro-N-(3-nitrophenyl)-, [(2,5-dichlorophenyl)sulfonyl](3-nitrophenyl)amine, 2,5-DICHLORO-N-(3-NITROPHENYL)BENZENE-1-SULFONAMIDE
| Molecular Formula | C12H8Cl2N2O4S |
|---|---|
| Molecular Weight | 345.96 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.9582 |
| Heavy Atoms | 21 |
| Complexity | 477.0 |
Chemical Identifiers
| CAS Number | 61072-86-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])NS(=O)(=O)C2=C(C=CC(=C2)Cl)Cl |
| InChIKey | JGUSYPCMGUFLIW-UHFFFAOYSA-N |
Product Overview
2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide (CAS 61072-86-4), with molecular formula C12H8Cl2N2O4S and molecular weight 345.96 g/mol. IUPAC: 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide.
Chemical Property Profile of 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide
Property Insights of 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide
The XLogP value of 3.5 indicates that 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide. Following Lipinski's Rule of Five, 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide 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 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide?
The CAS number of 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide is 61072-86-4.
What is the molecular formula of 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide?
The molecular formula of 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide is C12H8Cl2N2O4S.
What is the molecular weight of 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide?
The molecular weight of 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide is 345.96 g/mol.
Where can I buy 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide?
You can request a quote for 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 2,5-dichloro-N-(3-nitrophenyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.