5-bromo-N-(3-hydroxy-4-methylphenyl)pyridine-3-sulfonamide

C12H11BrN2O3S — CID 64794054

IUPAC5-bromo-N-(3-hydroxy-4-methylphenyl)pyridine-3-sulfonamide
SMILESCc1ccc(NS(=O)(=O)c2cncc(Br)c2)cc1O
InChIInChI=1S/C12H11BrN2O3S/c1-8-2-3-10(5-12(8)16)15-19(17,18)11-4-9(13)6-14-7-11/h2-7,15-16H,1H3
InChIKeyCNOPAKVPOWNZNI-UHFFFAOYSA-N
MW343.20 g/mol
LogP2.66
Rot. Bonds3

About 5-bromo-N-(3-hydroxy-4-methylphenyl)pyridine-3-sulfonamide

5-bromo-N-(3-hydroxy-4-methylphenyl)pyridine-3-sulfonamide (PubChem CID 64794054) has the molecular formula C12H11BrN2O3S and a molecular weight of 343.20 g/mol. Its IUPAC name is 5-bromo-N-(3-hydroxy-4-methylphenyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-bromo-N-(3-hydroxy-4-methylphenyl)pyridine-3-sulfonamide
PubChem CID64794054
Molecular FormulaC12H11BrN2O3S
Molecular Weight343.20 g/mol
Exact Mass341.97
IUPAC Name5-bromo-N-(3-hydroxy-4-methylphenyl)pyridine-3-sulfonamide
SMILESCc1ccc(NS(=O)(=O)c2cncc(Br)c2)cc1O
InChIInChI=1S/C12H11BrN2O3S/c1-8-2-3-10(5-12(8)16)15-19(17,18)11-4-9(13)6-14-7-11/h2-7,15-16H,1H3
InChIKeyCNOPAKVPOWNZNI-UHFFFAOYSA-N
XLogP2.66
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.20
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-hydroxy-4-methylphenyl)-3,4-dimethylbenzenesulfonamide
CID 64794059
4-amino-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide
CID 107699512
2,5-dibromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide
CID 64794052
5-bromo-N-(4-butylphenyl)pyridine-3-sulfonamide
CID 63422557
3-amino-4-hydroxy-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide
CID 107699434
4-bromo-2-chloro-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide
CID 64794050
5-bromo-N-(3-hydroxy-4-methylphenyl)thiophene-2-sulfonamide
CID 3818227
5-bromo-N-(3-hydroxy-4-methylphenyl)-4-methylthiophene-2-sulfonamide
CID 79934527
5-bromo-N-methylpyridine-3-sulfonamide
CID 46738979
5-bromo-N-(3-bromo-2-hydroxyphenyl)pyridine-3-sulfonamide
CID 81496242
N-(3-hydroxy-4-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 64794398
4-fluoro-N-(3-hydroxy-4-methylphenyl)-2,6-dimethylbenzenesulfonamide
CID 107327721

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(3-hydroxy-4-methylphenyl)pyridine-3-sulfonamide?
The IUPAC name of 5-bromo-N-(3-hydroxy-4-methylphenyl)pyridine-3-sulfonamide (CID 64794054) is 5-bromo-N-(3-hydroxy-4-methylphenyl)pyridine-3-sulfonamide.
What is the SMILES notation for 5-bromo-N-(3-hydroxy-4-methylphenyl)pyridine-3-sulfonamide?
The canonical SMILES for 5-bromo-N-(3-hydroxy-4-methylphenyl)pyridine-3-sulfonamide is Cc1ccc(NS(=O)(=O)c2cncc(Br)c2)cc1O.
What is the InChIKey of 5-bromo-N-(3-hydroxy-4-methylphenyl)pyridine-3-sulfonamide?
The InChIKey is CNOPAKVPOWNZNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrN2O3S/c1-8-2-3-10(5-12(8)16)15-19(17,18)11-4-9(13)6-14-7-11/h2-7,15-16H,1H3.
What are the key properties of 5-bromo-N-(3-hydroxy-4-methylphenyl)pyridine-3-sulfonamide?
5-bromo-N-(3-hydroxy-4-methylphenyl)pyridine-3-sulfonamide has a molecular weight of 343.20 g/mol, XLogP of 2.66, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(3-hydroxy-4-methylphenyl)pyridine-3-sulfonamide is sourced from PubChem (CID 64794054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).