N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide

C12H14N2O3S2 — CID 61477562

IUPACN-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide
SMILESCCc1nc(NS(=O)(=O)c2ccc(O)cc2)sc1C
InChIInChI=1S/C12H14N2O3S2/c1-3-11-8(2)18-12(13-11)14-19(16,17)10-6-4-9(15)5-7-10/h4-7,15H,3H2,1-2H3,(H,13,14)
InChIKeyGUGIGJWJTCGENO-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.52
Rot. Bonds4

About N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide

N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide (PubChem CID 61477562) has the molecular formula C12H14N2O3S2 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide.

Molecular Properties

Compound NameN-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide
PubChem CID61477562
Molecular FormulaC12H14N2O3S2
Molecular Weight298.39 g/mol
Exact Mass298.04
IUPAC NameN-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide
SMILESCCc1nc(NS(=O)(=O)c2ccc(O)cc2)sc1C
InChIInChI=1S/C12H14N2O3S2/c1-3-11-8(2)18-12(13-11)14-19(16,17)10-6-4-9(15)5-7-10/h4-7,15H,3H2,1-2H3,(H,13,14)
InChIKeyGUGIGJWJTCGENO-UHFFFAOYSA-N
XLogP2.52
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide?
The IUPAC name of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide (CID 61477562) is N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide.
What is the SMILES notation for N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide?
The canonical SMILES for N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide is CCc1nc(NS(=O)(=O)c2ccc(O)cc2)sc1C.
What is the InChIKey of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide?
The InChIKey is GUGIGJWJTCGENO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O3S2/c1-3-11-8(2)18-12(13-11)14-19(16,17)10-6-4-9(15)5-7-10/h4-7,15H,3H2,1-2H3,(H,13,14).
What are the key properties of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide?
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide has a molecular weight of 298.39 g/mol, XLogP of 2.52, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide is sourced from PubChem (CID 61477562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).