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

C11H9ClN2O2S — CID 49345861

IUPAC5-chloro-2-hydroxy-N-(1,3-thiazol-4-ylmethyl)benzamide
SMILESO=C(NCc1cscn1)c1cc(Cl)ccc1O
InChIInChI=1S/C11H9ClN2O2S/c12-7-1-2-10(15)9(3-7)11(16)13-4-8-5-17-6-14-8/h1-3,5-6,15H,4H2,(H,13,16)
InChIKeyGRMAXKVLNOYSLS-UHFFFAOYSA-N
MW268.72 g/mol
LogP2.43
Rot. Bonds3

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

5-chloro-2-hydroxy-N-(1,3-thiazol-4-ylmethyl)benzamide (PubChem CID 49345861) has the molecular formula C11H9ClN2O2S and a molecular weight of 268.72 g/mol. Its IUPAC name is 5-chloro-2-hydroxy-N-(1,3-thiazol-4-ylmethyl)benzamide.

Molecular Properties

Compound Name5-chloro-2-hydroxy-N-(1,3-thiazol-4-ylmethyl)benzamide
PubChem CID49345861
Molecular FormulaC11H9ClN2O2S
Molecular Weight268.72 g/mol
Exact Mass268.01
IUPAC Name5-chloro-2-hydroxy-N-(1,3-thiazol-4-ylmethyl)benzamide
SMILESO=C(NCc1cscn1)c1cc(Cl)ccc1O
InChIInChI=1S/C11H9ClN2O2S/c12-7-1-2-10(15)9(3-7)11(16)13-4-8-5-17-6-14-8/h1-3,5-6,15H,4H2,(H,13,16)
InChIKeyGRMAXKVLNOYSLS-UHFFFAOYSA-N
XLogP2.43
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.72
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,5-dihydroxy-N-(1,3-thiazol-4-ylmethyl)benzamide
CID 107723065
5-chloro-2-nitro-N-(1,3-thiazol-4-ylmethyl)benzamide
CID 62186371
5-chloro-2-hydroxy-N-[(5-methylpyrazin-2-yl)methyl]benzamide
CID 62848141
4-chloro-N-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide
CID 81232495
5-chloro-2-ethylsulfanyl-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide
CID 71974317
2-chloro-4-nitro-N-(1,3-thiazol-4-ylmethyl)benzamide
CID 49346153
5-chloro-N-[(3,4-difluorophenyl)methyl]-2-hydroxybenzamide
CID 60739890
2-iodo-N-(1,3-thiazol-4-ylmethyl)benzamide
CID 49346233
2-[(5-chloro-2-hydroxybenzoyl)amino]acetic acid
CID 15858288
4-chloro-N-[2-oxo-2-(1,3-thiazol-4-ylmethylamino)ethyl]benzamide
CID 46388432
5-chloro-2-fluoro-N-(1,3-thiazol-4-ylmethyl)aniline
CID 60696679
3-bromo-4-chloro-N-(1,3-thiazol-4-ylmethyl)benzamide
CID 103841851

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-hydroxy-N-(1,3-thiazol-4-ylmethyl)benzamide?
The IUPAC name of 5-chloro-2-hydroxy-N-(1,3-thiazol-4-ylmethyl)benzamide (CID 49345861) is 5-chloro-2-hydroxy-N-(1,3-thiazol-4-ylmethyl)benzamide.
What is the SMILES notation for 5-chloro-2-hydroxy-N-(1,3-thiazol-4-ylmethyl)benzamide?
The canonical SMILES for 5-chloro-2-hydroxy-N-(1,3-thiazol-4-ylmethyl)benzamide is O=C(NCc1cscn1)c1cc(Cl)ccc1O.
What is the InChIKey of 5-chloro-2-hydroxy-N-(1,3-thiazol-4-ylmethyl)benzamide?
The InChIKey is GRMAXKVLNOYSLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2O2S/c12-7-1-2-10(15)9(3-7)11(16)13-4-8-5-17-6-14-8/h1-3,5-6,15H,4H2,(H,13,16).
What are the key properties of 5-chloro-2-hydroxy-N-(1,3-thiazol-4-ylmethyl)benzamide?
5-chloro-2-hydroxy-N-(1,3-thiazol-4-ylmethyl)benzamide has a molecular weight of 268.72 g/mol, XLogP of 2.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-hydroxy-N-(1,3-thiazol-4-ylmethyl)benzamide is sourced from PubChem (CID 49345861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).