N-[4-(benzenesulfonyl)-1,3-thiazol-2-yl]-2-hydroxybenzamide

C16H12N2O4S2 — CID 50905290

IUPACN-[4-(benzenesulfonyl)-1,3-thiazol-2-yl]-2-hydroxybenzamide
SMILESO=C(Nc1nc(S(=O)(=O)c2ccccc2)cs1)c1ccccc1O
InChIInChI=1S/C16H12N2O4S2/c19-13-9-5-4-8-12(13)15(20)18-16-17-14(10-23-16)24(21,22)11-6-2-1-3-7-11/h1-10,19H,(H,17,18,20)
InChIKeyPBXGOCAHDMHAHJ-UHFFFAOYSA-N
MW360.42 g/mol
LogP2.93
Rot. Bonds4

About N-[4-(benzenesulfonyl)-1,3-thiazol-2-yl]-2-hydroxybenzamide

N-[4-(benzenesulfonyl)-1,3-thiazol-2-yl]-2-hydroxybenzamide (PubChem CID 50905290) has the molecular formula C16H12N2O4S2 and a molecular weight of 360.42 g/mol. Its IUPAC name is N-[4-(benzenesulfonyl)-1,3-thiazol-2-yl]-2-hydroxybenzamide.

Molecular Properties

Compound NameN-[4-(benzenesulfonyl)-1,3-thiazol-2-yl]-2-hydroxybenzamide
PubChem CID50905290
Molecular FormulaC16H12N2O4S2
Molecular Weight360.42 g/mol
Exact Mass360.02
IUPAC NameN-[4-(benzenesulfonyl)-1,3-thiazol-2-yl]-2-hydroxybenzamide
SMILESO=C(Nc1nc(S(=O)(=O)c2ccccc2)cs1)c1ccccc1O
InChIInChI=1S/C16H12N2O4S2/c19-13-9-5-4-8-12(13)15(20)18-16-17-14(10-23-16)24(21,22)11-6-2-1-3-7-11/h1-10,19H,(H,17,18,20)
InChIKeyPBXGOCAHDMHAHJ-UHFFFAOYSA-N
XLogP2.93
TPSA96.36 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.42
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-tert-butyl-1,3-thiazol-2-yl)-2-hydroxybenzamide
CID 807675
2-hydroxy-N-[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]benzamide
CID 134051886
[2-[(2-hydroxybenzoyl)amino]-1,3-thiazol-4-yl]methanesulfinate
CID 174617807
ethyl 2-[2-[(2-hydroxybenzoyl)amino]-1,3-thiazol-4-yl]acetate
CID 18139388
5-chloro-2-hydroxy-4-methyl-N-[4-[(6-methyl-2-pyridinyl)sulfonyl]-1,3-thiazol-2-yl]benzamide
CID 88570143
2-(benzenesulfonylmethyl)-N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]benzamide
CID 167827153
N-[4-[2-(naphthalene-1-carbonylamino)-1,3-thiazol-4-yl]-1,3-thiazol-2-yl]naphthalene-1-carboxamide
CID 5066416
[2-[(4-methylsulfonyl-1,3-thiazol-2-yl)carbamoyl]phenyl] hexanoate
CID 57329900
N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-2-methylsulfonylbenzamide
CID 7565481
2-chloro-N-[4-(4-methylsulfonylphenyl)-1,3-thiazol-2-yl]benzamide
CID 9246487
2-[2-[(4-naphthalen-1-yl-1,3-thiazol-2-yl)carbamoyl]phenyl]benzoic acid
CID 3228346
2-[(2-chlorobenzoyl)amino]-N-hydroxy-1,3-thiazole-4-carboxamide
CID 156904198

Frequently Asked Questions

What is the IUPAC name of N-[4-(benzenesulfonyl)-1,3-thiazol-2-yl]-2-hydroxybenzamide?
The IUPAC name of N-[4-(benzenesulfonyl)-1,3-thiazol-2-yl]-2-hydroxybenzamide (CID 50905290) is N-[4-(benzenesulfonyl)-1,3-thiazol-2-yl]-2-hydroxybenzamide.
What is the SMILES notation for N-[4-(benzenesulfonyl)-1,3-thiazol-2-yl]-2-hydroxybenzamide?
The canonical SMILES for N-[4-(benzenesulfonyl)-1,3-thiazol-2-yl]-2-hydroxybenzamide is O=C(Nc1nc(S(=O)(=O)c2ccccc2)cs1)c1ccccc1O.
What is the InChIKey of N-[4-(benzenesulfonyl)-1,3-thiazol-2-yl]-2-hydroxybenzamide?
The InChIKey is PBXGOCAHDMHAHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O4S2/c19-13-9-5-4-8-12(13)15(20)18-16-17-14(10-23-16)24(21,22)11-6-2-1-3-7-11/h1-10,19H,(H,17,18,20).
What are the key properties of N-[4-(benzenesulfonyl)-1,3-thiazol-2-yl]-2-hydroxybenzamide?
N-[4-(benzenesulfonyl)-1,3-thiazol-2-yl]-2-hydroxybenzamide has a molecular weight of 360.42 g/mol, XLogP of 2.93, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(benzenesulfonyl)-1,3-thiazol-2-yl]-2-hydroxybenzamide is sourced from PubChem (CID 50905290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).