4-methyl-2-(1,3-thiazol-2-yl)benzenesulfonamide

C10H10N2O2S2 — CID 151398732

IUPAC4-methyl-2-(1,3-thiazol-2-yl)benzenesulfonamide
SMILESCc1ccc(S(N)(=O)=O)c(-c2nccs2)c1
InChIInChI=1S/C10H10N2O2S2/c1-7-2-3-9(16(11,13)14)8(6-7)10-12-4-5-15-10/h2-6H,1H3,(H2,11,13,14)
InChIKeyOWAHWTDXKRYNQU-UHFFFAOYSA-N
MW254.34 g/mol
LogP1.77
Rot. Bonds2

About 4-methyl-2-(1,3-thiazol-2-yl)benzenesulfonamide

4-methyl-2-(1,3-thiazol-2-yl)benzenesulfonamide (PubChem CID 151398732) has the molecular formula C10H10N2O2S2 and a molecular weight of 254.34 g/mol. Its IUPAC name is 4-methyl-2-(1,3-thiazol-2-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-methyl-2-(1,3-thiazol-2-yl)benzenesulfonamide
PubChem CID151398732
Molecular FormulaC10H10N2O2S2
Molecular Weight254.34 g/mol
Exact Mass254.02
IUPAC Name4-methyl-2-(1,3-thiazol-2-yl)benzenesulfonamide
SMILESCc1ccc(S(N)(=O)=O)c(-c2nccs2)c1
InChIInChI=1S/C10H10N2O2S2/c1-7-2-3-9(16(11,13)14)8(6-7)10-12-4-5-15-10/h2-6H,1H3,(H2,11,13,14)
InChIKeyOWAHWTDXKRYNQU-UHFFFAOYSA-N
XLogP1.77
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.34
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(1,3-thiazol-2-yl)benzenesulfonamide?
The IUPAC name of 4-methyl-2-(1,3-thiazol-2-yl)benzenesulfonamide (CID 151398732) is 4-methyl-2-(1,3-thiazol-2-yl)benzenesulfonamide.
What is the SMILES notation for 4-methyl-2-(1,3-thiazol-2-yl)benzenesulfonamide?
The canonical SMILES for 4-methyl-2-(1,3-thiazol-2-yl)benzenesulfonamide is Cc1ccc(S(N)(=O)=O)c(-c2nccs2)c1.
What is the InChIKey of 4-methyl-2-(1,3-thiazol-2-yl)benzenesulfonamide?
The InChIKey is OWAHWTDXKRYNQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2S2/c1-7-2-3-9(16(11,13)14)8(6-7)10-12-4-5-15-10/h2-6H,1H3,(H2,11,13,14).
What are the key properties of 4-methyl-2-(1,3-thiazol-2-yl)benzenesulfonamide?
4-methyl-2-(1,3-thiazol-2-yl)benzenesulfonamide has a molecular weight of 254.34 g/mol, XLogP of 1.77, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(1,3-thiazol-2-yl)benzenesulfonamide is sourced from PubChem (CID 151398732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).