N-(3,4-dichlorophenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide

C16H13Cl2N3O2S — CID 42283346

IUPACN-(3,4-dichlorophenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide
SMILESCc1nn(-c2ccccc2)cc1S(=O)(=O)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C16H13Cl2N3O2S/c1-11-16(10-21(19-11)13-5-3-2-4-6-13)24(22,23)20-12-7-8-14(17)15(18)9-12/h2-10,20H,1H3
InChIKeyCBZZSVNPIQKJHN-UHFFFAOYSA-N
MW382.27 g/mol
LogP4.29
Rot. Bonds4

About N-(3,4-dichlorophenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide

N-(3,4-dichlorophenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide (PubChem CID 42283346) has the molecular formula C16H13Cl2N3O2S and a molecular weight of 382.27 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide
PubChem CID42283346
Molecular FormulaC16H13Cl2N3O2S
Molecular Weight382.27 g/mol
Exact Mass381.01
IUPAC NameN-(3,4-dichlorophenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide
SMILESCc1nn(-c2ccccc2)cc1S(=O)(=O)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C16H13Cl2N3O2S/c1-11-16(10-21(19-11)13-5-3-2-4-6-13)24(22,23)20-12-7-8-14(17)15(18)9-12/h2-10,20H,1H3
InChIKeyCBZZSVNPIQKJHN-UHFFFAOYSA-N
XLogP4.29
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.27
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3,4-dichlorophenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide 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

3-methyl-1-phenyl-N-[3-(trifluoromethyl)phenyl]pyrazole-4-sulfonamide
CID 42283326
N-(2,6-dimethylphenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide
CID 42283357
N-(3,4-dichlorophenyl)-3,5-dimethyl-1-phenylpyrazole-4-sulfonamide
CID 22773571
N-(2-ethylphenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide
CID 42283313
N-(4,5-dihydro-1,3-thiazol-2-yl)-3-methyl-1-phenylpyrazole-4-sulfonamide
CID 42283379
N-(4-bromo-3-methylphenyl)-3-tert-butyl-1-phenylpyrazole-4-sulfonamide
CID 42284783
N-benzyl-3-methyl-1-phenylpyrazole-4-sulfonamide
CID 42283268
N-(2-ethoxyphenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide
CID 42283333
3-methyl-N-pentyl-1-phenylpyrazole-4-sulfonamide
CID 42283296
2,4,5-trichloro-N-(3,4-dichlorophenyl)benzenesulfonamide
CID 22773572
N-(2,2-diethoxyethyl)-3-methyl-1-phenylpyrazole-4-sulfonamide
CID 42283238
1,3-dimethyl-N-phenylpyrazole-4-sulfonamide
CID 17377259

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide?
The IUPAC name of N-(3,4-dichlorophenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide (CID 42283346) is N-(3,4-dichlorophenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide is Cc1nn(-c2ccccc2)cc1S(=O)(=O)Nc1ccc(Cl)c(Cl)c1.
What is the InChIKey of N-(3,4-dichlorophenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide?
The InChIKey is CBZZSVNPIQKJHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13Cl2N3O2S/c1-11-16(10-21(19-11)13-5-3-2-4-6-13)24(22,23)20-12-7-8-14(17)15(18)9-12/h2-10,20H,1H3.
What are the key properties of N-(3,4-dichlorophenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide?
N-(3,4-dichlorophenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide has a molecular weight of 382.27 g/mol, XLogP of 4.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-3-methyl-1-phenylpyrazole-4-sulfonamide is sourced from PubChem (CID 42283346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).