2-(benzenesulfonamido)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide

C17H15N3O3S2 — CID 1132235

IUPAC2-(benzenesulfonamido)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide
SMILESCc1nc(NS(=O)(=O)c2ccccc2)sc1C(=O)Nc1ccccc1
InChIInChI=1S/C17H15N3O3S2/c1-12-15(16(21)19-13-8-4-2-5-9-13)24-17(18-12)20-25(22,23)14-10-6-3-7-11-14/h2-11H,1H3,(H,18,20)(H,19,21)
InChIKeyGKYBLAKCJDEAKK-UHFFFAOYSA-N
MW373.46 g/mol
LogP3.50
Rot. Bonds5

About 2-(benzenesulfonamido)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide

2-(benzenesulfonamido)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide (PubChem CID 1132235) has the molecular formula C17H15N3O3S2 and a molecular weight of 373.46 g/mol. Its IUPAC name is 2-(benzenesulfonamido)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-(benzenesulfonamido)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide
PubChem CID1132235
Molecular FormulaC17H15N3O3S2
Molecular Weight373.46 g/mol
Exact Mass373.06
IUPAC Name2-(benzenesulfonamido)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide
SMILESCc1nc(NS(=O)(=O)c2ccccc2)sc1C(=O)Nc1ccccc1
InChIInChI=1S/C17H15N3O3S2/c1-12-15(16(21)19-13-8-4-2-5-9-13)24-17(18-12)20-25(22,23)14-10-6-3-7-11-14/h2-11H,1H3,(H,18,20)(H,19,21)
InChIKeyGKYBLAKCJDEAKK-UHFFFAOYSA-N
XLogP3.50
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(benzenesulfonamido)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonamido)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-(benzenesulfonamido)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide (CID 1132235) is 2-(benzenesulfonamido)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-(benzenesulfonamido)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-(benzenesulfonamido)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide is Cc1nc(NS(=O)(=O)c2ccccc2)sc1C(=O)Nc1ccccc1.
What is the InChIKey of 2-(benzenesulfonamido)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide?
The InChIKey is GKYBLAKCJDEAKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O3S2/c1-12-15(16(21)19-13-8-4-2-5-9-13)24-17(18-12)20-25(22,23)14-10-6-3-7-11-14/h2-11H,1H3,(H,18,20)(H,19,21).
What are the key properties of 2-(benzenesulfonamido)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide?
2-(benzenesulfonamido)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide has a molecular weight of 373.46 g/mol, XLogP of 3.50, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzenesulfonamido)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 1132235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).