5-(2-anilino-1,3-thiazol-4-yl)-2-hydroxybenzamide

C16H13N3O2S — CID 4794329

IUPAC5-(2-anilino-1,3-thiazol-4-yl)-2-hydroxybenzamide
SMILESNC(=O)c1cc(-c2csc(Nc3ccccc3)n2)ccc1O
InChIInChI=1S/C16H13N3O2S/c17-15(21)12-8-10(6-7-14(12)20)13-9-22-16(19-13)18-11-4-2-1-3-5-11/h1-9,20H,(H2,17,21)(H,18,19)
InChIKeyHIFWZQNCMNKNNP-UHFFFAOYSA-N
MW311.37 g/mol
LogP3.36
Rot. Bonds4

About 5-(2-anilino-1,3-thiazol-4-yl)-2-hydroxybenzamide

5-(2-anilino-1,3-thiazol-4-yl)-2-hydroxybenzamide (PubChem CID 4794329) has the molecular formula C16H13N3O2S and a molecular weight of 311.37 g/mol. Its IUPAC name is 5-(2-anilino-1,3-thiazol-4-yl)-2-hydroxybenzamide.

Molecular Properties

Compound Name5-(2-anilino-1,3-thiazol-4-yl)-2-hydroxybenzamide
PubChem CID4794329
Molecular FormulaC16H13N3O2S
Molecular Weight311.37 g/mol
Exact Mass311.07
IUPAC Name5-(2-anilino-1,3-thiazol-4-yl)-2-hydroxybenzamide
SMILESNC(=O)c1cc(-c2csc(Nc3ccccc3)n2)ccc1O
InChIInChI=1S/C16H13N3O2S/c17-15(21)12-8-10(6-7-14(12)20)13-9-22-16(19-13)18-11-4-2-1-3-5-11/h1-9,20H,(H2,17,21)(H,18,19)
InChIKeyHIFWZQNCMNKNNP-UHFFFAOYSA-N
XLogP3.36
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.37
LogP ≤ 53.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-{[4-(4-Fluoro-3-methylphenyl)-1,3-thiazol-2-yl]amino}-2-hydroxybenzoic acid
CID 695906
4-{[4-(2-Methoxyphenyl)-1,3-thiazol-2-yl]amino}benzoic acid
CID 24776309
3-(4-(4-Hydroxyphenyl)thiazol-2-ylamino)phenol
CID 3324368
Benzamide, N-2-benzothiazolyl-2-hydroxy-
CID 696305
2-hydroxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
CID 747501
4-{[4-(4-Chlorophenyl)-1,3-thiazol-2-yl]amino}-2-hydroxybenzoic acid
CID 2212684
2-hydroxy-4-[(4-naphthalen-2-yl-1,3-thiazol-2-yl)amino]benzoic Acid
CID 7328982
4-[(4-Phenyl-1,3-thiazol-2-yl)amino]benzoic acid
CID 877536
N-(4,5-Dimethyl-thiazol-2-yl)-2-hydroxy-benzamide
CID 807671
N-(4-tert-Butyl-thiazol-2-yl)-2-hydroxy-benzamide
CID 807675
2-hydroxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 659766
3-[2-(2-Methylanilino)-1,3-thiazol-4-yl]benzoic acid
CID 147535030

Frequently Asked Questions

What is the IUPAC name of 5-(2-anilino-1,3-thiazol-4-yl)-2-hydroxybenzamide?
The IUPAC name of 5-(2-anilino-1,3-thiazol-4-yl)-2-hydroxybenzamide (CID 4794329) is 5-(2-anilino-1,3-thiazol-4-yl)-2-hydroxybenzamide.
What is the SMILES notation for 5-(2-anilino-1,3-thiazol-4-yl)-2-hydroxybenzamide?
The canonical SMILES for 5-(2-anilino-1,3-thiazol-4-yl)-2-hydroxybenzamide is NC(=O)c1cc(-c2csc(Nc3ccccc3)n2)ccc1O.
What is the InChIKey of 5-(2-anilino-1,3-thiazol-4-yl)-2-hydroxybenzamide?
The InChIKey is HIFWZQNCMNKNNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2S/c17-15(21)12-8-10(6-7-14(12)20)13-9-22-16(19-13)18-11-4-2-1-3-5-11/h1-9,20H,(H2,17,21)(H,18,19).
What are the key properties of 5-(2-anilino-1,3-thiazol-4-yl)-2-hydroxybenzamide?
5-(2-anilino-1,3-thiazol-4-yl)-2-hydroxybenzamide has a molecular weight of 311.37 g/mol, XLogP of 3.36, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-anilino-1,3-thiazol-4-yl)-2-hydroxybenzamide is sourced from PubChem (CID 4794329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).