4-[[5-(3-hydroxyphenyl)-1H-pyrazol-3-yl]amino]benzenesulfonamide

C15H14N4O3S — CID 6539620

IUPAC4-[[5-(3-hydroxyphenyl)-1H-pyrazol-3-yl]amino]benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(Nc2cc(-c3cccc(O)c3)[nH]n2)cc1
InChIInChI=1S/C15H14N4O3S/c16-23(21,22)13-6-4-11(5-7-13)17-15-9-14(18-19-15)10-2-1-3-12(20)8-10/h1-9,20H,(H2,16,21,22)(H2,17,18,19)
InChIKeyPVLOKYREDKFWTF-UHFFFAOYSA-N
MW330.37 g/mol
LogP2.17
Rot. Bonds4

About 4-[[5-(3-hydroxyphenyl)-1H-pyrazol-3-yl]amino]benzenesulfonamide

4-[[5-(3-hydroxyphenyl)-1H-pyrazol-3-yl]amino]benzenesulfonamide (PubChem CID 6539620) has the molecular formula C15H14N4O3S and a molecular weight of 330.37 g/mol. Its IUPAC name is 4-[[5-(3-hydroxyphenyl)-1H-pyrazol-3-yl]amino]benzenesulfonamide.

Molecular Properties

Compound Name4-[[5-(3-hydroxyphenyl)-1H-pyrazol-3-yl]amino]benzenesulfonamide
PubChem CID6539620
Molecular FormulaC15H14N4O3S
Molecular Weight330.37 g/mol
Exact Mass330.08
IUPAC Name4-[[5-(3-hydroxyphenyl)-1H-pyrazol-3-yl]amino]benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(Nc2cc(-c3cccc(O)c3)[nH]n2)cc1
InChIInChI=1S/C15H14N4O3S/c16-23(21,22)13-6-4-11(5-7-13)17-15-9-14(18-19-15)10-2-1-3-12(20)8-10/h1-9,20H,(H2,16,21,22)(H2,17,18,19)
InChIKeyPVLOKYREDKFWTF-UHFFFAOYSA-N
XLogP2.17
TPSA121.10 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.37
LogP ≤ 52.17
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze 4-[[5-(3-hydroxyphenyl)-1H-pyrazol-3-yl]amino]benzenesulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[[5-(3-hydroxyphenyl)-1H-pyrazol-3-yl]amino]benzenesulfonamide?
The IUPAC name of 4-[[5-(3-hydroxyphenyl)-1H-pyrazol-3-yl]amino]benzenesulfonamide (CID 6539620) is 4-[[5-(3-hydroxyphenyl)-1H-pyrazol-3-yl]amino]benzenesulfonamide.
What is the SMILES notation for 4-[[5-(3-hydroxyphenyl)-1H-pyrazol-3-yl]amino]benzenesulfonamide?
The canonical SMILES for 4-[[5-(3-hydroxyphenyl)-1H-pyrazol-3-yl]amino]benzenesulfonamide is NS(=O)(=O)c1ccc(Nc2cc(-c3cccc(O)c3)[nH]n2)cc1.
What is the InChIKey of 4-[[5-(3-hydroxyphenyl)-1H-pyrazol-3-yl]amino]benzenesulfonamide?
The InChIKey is PVLOKYREDKFWTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O3S/c16-23(21,22)13-6-4-11(5-7-13)17-15-9-14(18-19-15)10-2-1-3-12(20)8-10/h1-9,20H,(H2,16,21,22)(H2,17,18,19).
What are the key properties of 4-[[5-(3-hydroxyphenyl)-1H-pyrazol-3-yl]amino]benzenesulfonamide?
4-[[5-(3-hydroxyphenyl)-1H-pyrazol-3-yl]amino]benzenesulfonamide has a molecular weight of 330.37 g/mol, XLogP of 2.17, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[5-(3-hydroxyphenyl)-1H-pyrazol-3-yl]amino]benzenesulfonamide is sourced from PubChem (CID 6539620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).