3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide

C9H7Cl2N3O2S — CID 43532761

IUPAC3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1cn[nH]c1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C9H7Cl2N3O2S/c10-6-1-7(11)3-9(2-6)17(15,16)14-8-4-12-13-5-8/h1-5,14H,(H,12,13)
InChIKeyYYYCJNJPPXVDQB-UHFFFAOYSA-N
MW292.15 g/mol
LogP2.52
Rot. Bonds3

About 3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide

3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide (PubChem CID 43532761) has the molecular formula C9H7Cl2N3O2S and a molecular weight of 292.15 g/mol. Its IUPAC name is 3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide.

Molecular Properties

Compound Name3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide
PubChem CID43532761
Molecular FormulaC9H7Cl2N3O2S
Molecular Weight292.15 g/mol
Exact Mass290.96
IUPAC Name3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1cn[nH]c1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C9H7Cl2N3O2S/c10-6-1-7(11)3-9(2-6)17(15,16)14-8-4-12-13-5-8/h1-5,14H,(H,12,13)
InChIKeyYYYCJNJPPXVDQB-UHFFFAOYSA-N
XLogP2.52
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.15
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-methylsulfonyl-N-(1H-pyrazol-4-yl)benzenesulfonamide
CID 43532785
2-chloro-N-(1H-pyrazol-4-yl)quinoline-6-sulfonamide
CID 43540237
3-amino-4-fluoro-N-(1H-pyrazol-4-yl)benzenesulfonamide
CID 43539756
2-(methylamino)-N-(1H-pyrazol-4-yl)pyrimidine-5-sulfonamide
CID 62145901
5-chloro-2-methyl-3-(1H-pyrazol-4-ylsulfamoyl)benzoic acid
CID 82890326
2-hydrazinyl-N-(1H-pyrazol-4-yl)pyrimidine-5-sulfonamide
CID 61328332
4-chloro-2-methoxy-N-(1H-pyrazol-4-yl)benzenesulfonamide
CID 43540598
3,4-dimethoxy-N-(1H-pyrazol-4-yl)benzenesulfonamide
CID 43532732
3-cyano-4-fluoro-N-(1H-pyrazol-4-yl)benzenesulfonamide
CID 63288126
3,5-dichloro-N-pyridin-3-ylbenzenesulfonamide
CID 3269893
N-[3,5-bis(trifluoromethyl)phenyl]-3,5-dichlorobenzenesulfonamide
CID 25022575
3,5-dichloro-N-[4-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide
CID 72547025

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide?
The IUPAC name of 3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide (CID 43532761) is 3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide.
What is the SMILES notation for 3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide?
The canonical SMILES for 3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide is O=S(=O)(Nc1cn[nH]c1)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide?
The InChIKey is YYYCJNJPPXVDQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7Cl2N3O2S/c10-6-1-7(11)3-9(2-6)17(15,16)14-8-4-12-13-5-8/h1-5,14H,(H,12,13).
What are the key properties of 3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide?
3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide has a molecular weight of 292.15 g/mol, XLogP of 2.52, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide is sourced from PubChem (CID 43532761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).