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

C11H12N2O2S2 — CID 134350753

IUPACN-methyl-4-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide
SMILESCNS(=O)(=O)c1ccc(-c2csc(C)n2)cc1
InChIInChI=1S/C11H12N2O2S2/c1-8-13-11(7-16-8)9-3-5-10(6-4-9)17(14,15)12-2/h3-7,12H,1-2H3
InChIKeyQCOSQWZJSBDKLX-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.03
Rot. Bonds3

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

N-methyl-4-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide (PubChem CID 134350753) has the molecular formula C11H12N2O2S2 and a molecular weight of 268.36 g/mol. Its IUPAC name is N-methyl-4-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-methyl-4-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide
PubChem CID134350753
Molecular FormulaC11H12N2O2S2
Molecular Weight268.36 g/mol
Exact Mass268.03
IUPAC NameN-methyl-4-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide
SMILESCNS(=O)(=O)c1ccc(-c2csc(C)n2)cc1
InChIInChI=1S/C11H12N2O2S2/c1-8-13-11(7-16-8)9-3-5-10(6-4-9)17(14,15)12-2/h3-7,12H,1-2H3
InChIKeyQCOSQWZJSBDKLX-UHFFFAOYSA-N
XLogP2.03
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-methyl-1,3-thiazol-4-yl)benzenesulfonic acid
CID 118293667
4-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide
CID 43173625
4-chloro-N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]benzenesulfonamide
CID 108780120
2-methyl-4-[4-(sulfamoylamino)phenyl]-1,3-thiazole
CID 112573169
N-methyl-4-[(4-pyridin-4-yl-1,3-thiazol-2-yl)amino]benzenesulfonamide
CID 155312775
4-(2,5-dioxopyrrolidin-1-yl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzenesulfonamide
CID 122286657
N-methyl-4-[(2-methyl-1,3-thiazol-4-yl)methylamino]benzenesulfonamide
CID 43742551
3-[4-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]sulfamoyl]phenyl]propanoate
CID 8841474
N-[4-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethylsulfamoyl]phenyl]acetamide
CID 108780119
1-(5-bromo-1,3-thiazol-2-yl)-3-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]sulfonylurea
CID 24751655
5-(ethylsulfamoyl)-2-methyl-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 27167610
N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]benzenesulfonamide
CID 684183

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide?
The IUPAC name of N-methyl-4-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide (CID 134350753) is N-methyl-4-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide.
What is the SMILES notation for N-methyl-4-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide?
The canonical SMILES for N-methyl-4-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide is CNS(=O)(=O)c1ccc(-c2csc(C)n2)cc1.
What is the InChIKey of N-methyl-4-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide?
The InChIKey is QCOSQWZJSBDKLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2S2/c1-8-13-11(7-16-8)9-3-5-10(6-4-9)17(14,15)12-2/h3-7,12H,1-2H3.
What are the key properties of N-methyl-4-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide?
N-methyl-4-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide has a molecular weight of 268.36 g/mol, XLogP of 2.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide is sourced from PubChem (CID 134350753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).