2-hydroxy-N-(4-methylsulfinyl-1,3-thiazol-2-yl)benzamide

C11H10N2O3S2 — CID 56958614

IUPAC2-hydroxy-N-(4-methylsulfinyl-1,3-thiazol-2-yl)benzamide
SMILESCS(=O)c1csc(NC(=O)c2ccccc2O)n1
InChIInChI=1S/C11H10N2O3S2/c1-18(16)9-6-17-11(12-9)13-10(15)7-4-2-3-5-8(7)14/h2-6,14H,1H3,(H,12,13,15)
InChIKeyOETRJUMTRHUYHI-UHFFFAOYSA-N
MW282.35 g/mol
LogP1.84
Rot. Bonds3

About 2-hydroxy-N-(4-methylsulfinyl-1,3-thiazol-2-yl)benzamide

2-hydroxy-N-(4-methylsulfinyl-1,3-thiazol-2-yl)benzamide (PubChem CID 56958614) has the molecular formula C11H10N2O3S2 and a molecular weight of 282.35 g/mol. Its IUPAC name is 2-hydroxy-N-(4-methylsulfinyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-hydroxy-N-(4-methylsulfinyl-1,3-thiazol-2-yl)benzamide
PubChem CID56958614
Molecular FormulaC11H10N2O3S2
Molecular Weight282.35 g/mol
Exact Mass282.01
IUPAC Name2-hydroxy-N-(4-methylsulfinyl-1,3-thiazol-2-yl)benzamide
SMILESCS(=O)c1csc(NC(=O)c2ccccc2O)n1
InChIInChI=1S/C11H10N2O3S2/c1-18(16)9-6-17-11(12-9)13-10(15)7-4-2-3-5-8(7)14/h2-6,14H,1H3,(H,12,13,15)
InChIKeyOETRJUMTRHUYHI-UHFFFAOYSA-N
XLogP1.84
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(4-methylsulfinyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2-hydroxy-N-(4-methylsulfinyl-1,3-thiazol-2-yl)benzamide (CID 56958614) is 2-hydroxy-N-(4-methylsulfinyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2-hydroxy-N-(4-methylsulfinyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2-hydroxy-N-(4-methylsulfinyl-1,3-thiazol-2-yl)benzamide is CS(=O)c1csc(NC(=O)c2ccccc2O)n1.
What is the InChIKey of 2-hydroxy-N-(4-methylsulfinyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is OETRJUMTRHUYHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3S2/c1-18(16)9-6-17-11(12-9)13-10(15)7-4-2-3-5-8(7)14/h2-6,14H,1H3,(H,12,13,15).
What are the key properties of 2-hydroxy-N-(4-methylsulfinyl-1,3-thiazol-2-yl)benzamide?
2-hydroxy-N-(4-methylsulfinyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 282.35 g/mol, XLogP of 1.84, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(4-methylsulfinyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 56958614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).