N-{[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]carbamothioyl}benzamide
Chemical Structure Depiction of
N-{[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]carbamothioyl}benzamide
N-{[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]carbamothioyl}benzamide
Compound characteristics
Compound ID: | Y501-6001 |
Compound Name: | N-{[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]carbamothioyl}benzamide |
Molecular Weight: | 381.52 |
Molecular Formula: | C20 H19 N3 O S2 |
Smiles: | CCc1ccc(cc1)c1c(C)sc(NC(NC(c2ccccc2)=O)=S)n1 |
Stereo: | ACHIRAL |
logP: | 5.7321 |
logD: | 5.732 |
logSw: | -5.5436 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 43.785 |
InChI Key: | SZZLYCCZFXRYDZ-UHFFFAOYSA-N |