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

C15H11Cl2N3O2S — CID 72547025

IUPAC3,5-dichloro-N-[4-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(-c2ccn[nH]2)cc1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H11Cl2N3O2S/c16-11-7-12(17)9-14(8-11)23(21,22)20-13-3-1-10(2-4-13)15-5-6-18-19-15/h1-9,20H,(H,18,19)
InChIKeyVTPLTXZKMKTFBQ-UHFFFAOYSA-N
MW368.25 g/mol
LogP4.18
Rot. Bonds4

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

3,5-dichloro-N-[4-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide (PubChem CID 72547025) has the molecular formula C15H11Cl2N3O2S and a molecular weight of 368.25 g/mol. Its IUPAC name is 3,5-dichloro-N-[4-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide.

Molecular Properties

Compound Name3,5-dichloro-N-[4-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide
PubChem CID72547025
Molecular FormulaC15H11Cl2N3O2S
Molecular Weight368.25 g/mol
Exact Mass366.99
IUPAC Name3,5-dichloro-N-[4-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(-c2ccn[nH]2)cc1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H11Cl2N3O2S/c16-11-7-12(17)9-14(8-11)23(21,22)20-13-3-1-10(2-4-13)15-5-6-18-19-15/h1-9,20H,(H,18,19)
InChIKeyVTPLTXZKMKTFBQ-UHFFFAOYSA-N
XLogP4.18
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.25
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-fluoro-3-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide
CID 110732433
2-chloro-N-[4-(1H-pyrazol-5-yl)phenyl]-1,3-thiazole-5-sulfonamide
CID 61047553
N-(4-chlorophenyl)-4-(1H-pyrazol-5-yl)thiophene-2-sulfonamide
CID 53130896
3,5-dichloro-N-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide
CID 78843376
3,5-dichloro-N-[4-(4-methyl-3-pyridinyl)phenyl]benzenesulfonamide
CID 66714618
3,5-dichloro-N-(1H-pyrazol-4-yl)benzenesulfonamide
CID 43532761
3,5-dichloro-N-pyridin-3-ylbenzenesulfonamide
CID 3269893
3,5-dichloro-N-[4-(dimethylsulfamoyl)phenyl]benzenesulfonamide
CID 8603698
5-ethyl-N-[4-(1H-pyrazol-5-yl)phenyl]thiophene-2-sulfonamide
CID 110732438
5-[4-[[methyl(propan-2-yl)sulfamoyl]amino]phenyl]-1H-pyrazole
CID 61453983
3,5-dichloro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide
CID 103775753
N-(6-amino-3-pyridinyl)-3,5-dichlorobenzenesulfonamide
CID 55025804

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-[4-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide?
The IUPAC name of 3,5-dichloro-N-[4-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide (CID 72547025) is 3,5-dichloro-N-[4-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide.
What is the SMILES notation for 3,5-dichloro-N-[4-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide?
The canonical SMILES for 3,5-dichloro-N-[4-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide is O=S(=O)(Nc1ccc(-c2ccn[nH]2)cc1)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichloro-N-[4-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide?
The InChIKey is VTPLTXZKMKTFBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2N3O2S/c16-11-7-12(17)9-14(8-11)23(21,22)20-13-3-1-10(2-4-13)15-5-6-18-19-15/h1-9,20H,(H,18,19).
What are the key properties of 3,5-dichloro-N-[4-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide?
3,5-dichloro-N-[4-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide has a molecular weight of 368.25 g/mol, XLogP of 4.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-[4-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide is sourced from PubChem (CID 72547025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).