5-chloro-2-hydroxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide

C15H10ClN3O2S — CID 18127536

IUPAC5-chloro-2-hydroxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1nc(-c2cccnc2)cs1)c1cc(Cl)ccc1O
InChIInChI=1S/C15H10ClN3O2S/c16-10-3-4-13(20)11(6-10)14(21)19-15-18-12(8-22-15)9-2-1-5-17-7-9/h1-8,20H,(H,18,19,21)
InChIKeyWKKPAGJMFYKPKV-UHFFFAOYSA-N
MW331.78 g/mol
LogP3.82
Rot. Bonds3

About 5-chloro-2-hydroxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide

5-chloro-2-hydroxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide (PubChem CID 18127536) has the molecular formula C15H10ClN3O2S and a molecular weight of 331.78 g/mol. Its IUPAC name is 5-chloro-2-hydroxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name5-chloro-2-hydroxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide
PubChem CID18127536
Molecular FormulaC15H10ClN3O2S
Molecular Weight331.78 g/mol
Exact Mass331.02
IUPAC Name5-chloro-2-hydroxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1nc(-c2cccnc2)cs1)c1cc(Cl)ccc1O
InChIInChI=1S/C15H10ClN3O2S/c16-10-3-4-13(20)11(6-10)14(21)19-15-18-12(8-22-15)9-2-1-5-17-7-9/h1-8,20H,(H,18,19,21)
InChIKeyWKKPAGJMFYKPKV-UHFFFAOYSA-N
XLogP3.82
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.78
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-hydroxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide
CID 60097661
2-(4-hydroxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide
CID 60097708
2-Hydroxy-4-(4-pyridin-3-yl-thiazol-2-ylamino)-benzoic acid
CID 972853
3-chloro-2-hydroxy-N-(4-phenylthiazol-2-yl)benzamide
CID 53309543
2-hydroxy-N-[4-(2-pyridyl)thiazol-2-yl]benzamide
CID 72206228
5-chloro-2-hydroxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide
CID 164608819
2-methoxy-N-[4-(2-pyridyl)thiazol-2-yl]benzamide
CID 2660433
5-chloro-2-hydroxy-N-(4-methylthiazol-2-yl)benzamide
CID 6481048
5-chloro-2-hydroxy-N-(thiazol-2-yl)benzamide
CID 18103922
5-[2-(3-Chloroanilino)thiazol-5-yl]-2-hydroxy-benzamide
CID 5276249
5-[2-(4-Chloroanilino)thiazol-5-yl]-2-hydroxy-benzamide
CID 5276250
5-chloro-2-hydroxy-N-(4-methylpyrimidin-2-yl)benzamide
CID 6481045

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-hydroxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 5-chloro-2-hydroxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide (CID 18127536) is 5-chloro-2-hydroxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 5-chloro-2-hydroxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 5-chloro-2-hydroxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide is O=C(Nc1nc(-c2cccnc2)cs1)c1cc(Cl)ccc1O.
What is the InChIKey of 5-chloro-2-hydroxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide?
The InChIKey is WKKPAGJMFYKPKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClN3O2S/c16-10-3-4-13(20)11(6-10)14(21)19-15-18-12(8-22-15)9-2-1-5-17-7-9/h1-8,20H,(H,18,19,21).
What are the key properties of 5-chloro-2-hydroxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide?
5-chloro-2-hydroxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide has a molecular weight of 331.78 g/mol, XLogP of 3.82, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-hydroxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 18127536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).