N-{[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]carbamothioyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]carbamothioyl}thiophene-2-carboxamide
N-{[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]carbamothioyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y501-6012 |
| Compound Name: | N-{[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]carbamothioyl}thiophene-2-carboxamide |
| Molecular Weight: | 387.54 |
| Molecular Formula: | C18 H17 N3 O S3 |
| Smiles: | CCc1ccc(cc1)c1c(C)sc(NC(NC(c2cccs2)=O)=S)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.7498 |
| logD: | 5.7496 |
| logSw: | -5.4211 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 44.803 |
| InChI Key: | GXYKFTGNKSMLDA-UHFFFAOYSA-N |