2-hydroxy-5-methoxy-N-[3-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide

C16H15N3O4S — CID 146087314

IUPAC2-hydroxy-5-methoxy-N-[3-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide
SMILESCOc1ccc(O)c(S(=O)(=O)Nc2cccc(-c3cn[nH]c3)c2)c1
InChIInChI=1S/C16H15N3O4S/c1-23-14-5-6-15(20)16(8-14)24(21,22)19-13-4-2-3-11(7-13)12-9-17-18-10-12/h2-10,19-20H,1H3,(H,17,18)
InChIKeyHNRNFZJBJQZAFA-UHFFFAOYSA-N
MW345.38 g/mol
LogP2.59
Rot. Bonds5

About 2-hydroxy-5-methoxy-N-[3-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide

2-hydroxy-5-methoxy-N-[3-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide (PubChem CID 146087314) has the molecular formula C16H15N3O4S and a molecular weight of 345.38 g/mol. Its IUPAC name is 2-hydroxy-5-methoxy-N-[3-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide.

Molecular Properties

Compound Name2-hydroxy-5-methoxy-N-[3-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide
PubChem CID146087314
Molecular FormulaC16H15N3O4S
Molecular Weight345.38 g/mol
Exact Mass345.08
IUPAC Name2-hydroxy-5-methoxy-N-[3-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide
SMILESCOc1ccc(O)c(S(=O)(=O)Nc2cccc(-c3cn[nH]c3)c2)c1
InChIInChI=1S/C16H15N3O4S/c1-23-14-5-6-15(20)16(8-14)24(21,22)19-13-4-2-3-11(7-13)12-9-17-18-10-12/h2-10,19-20H,1H3,(H,17,18)
InChIKeyHNRNFZJBJQZAFA-UHFFFAOYSA-N
XLogP2.59
TPSA104.31 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.38
LogP ≤ 52.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-2-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]benzenesulfonamide
CID 47062849
8-hydroxy-N-(3-methoxyphenyl)quinoline-4-sulfonamide
CID 11158687
N-[3-(1H-pyrazol-4-yl)phenyl]cyclopropanecarboxamide
CID 166188841
2,5-dimethoxy-N-(3-methylphenyl)benzenesulfonamide
CID 3383057
N-[3-(6-ethoxypyridazin-3-yl)phenyl]-2,5-dimethoxybenzenesulfonamide
CID 7553670
2,5-dimethoxy-N-[3-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]benzenesulfonamide
CID 110418422
4-(difluoromethoxy)-3-fluoro-N-[3-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide
CID 146091956
2-hydroxy-5-methyl-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzenesulfonamide
CID 71886439
2,5-dimethoxy-N-[3-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]benzenesulfonamide
CID 91127010
methyl N-[3-[(2,5-dimethoxyphenyl)sulfonylamino]phenyl]carbamate
CID 71890321
4-methoxy-N-[3-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide
CID 110720303
N-(3-methoxyphenyl)-2-[2-[(3-methoxyphenyl)sulfamoyl]phenyl]benzenesulfonamide
CID 122220853

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-methoxy-N-[3-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide?
The IUPAC name of 2-hydroxy-5-methoxy-N-[3-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide (CID 146087314) is 2-hydroxy-5-methoxy-N-[3-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide.
What is the SMILES notation for 2-hydroxy-5-methoxy-N-[3-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide?
The canonical SMILES for 2-hydroxy-5-methoxy-N-[3-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide is COc1ccc(O)c(S(=O)(=O)Nc2cccc(-c3cn[nH]c3)c2)c1.
What is the InChIKey of 2-hydroxy-5-methoxy-N-[3-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide?
The InChIKey is HNRNFZJBJQZAFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O4S/c1-23-14-5-6-15(20)16(8-14)24(21,22)19-13-4-2-3-11(7-13)12-9-17-18-10-12/h2-10,19-20H,1H3,(H,17,18).
What are the key properties of 2-hydroxy-5-methoxy-N-[3-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide?
2-hydroxy-5-methoxy-N-[3-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide has a molecular weight of 345.38 g/mol, XLogP of 2.59, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-methoxy-N-[3-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide is sourced from PubChem (CID 146087314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).