ethyl 4-methyl-2-{2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 4-methyl-2-{2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}-1,3-thiazole-5-carboxylate
ethyl 4-methyl-2-{2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | 4707-0034 |
| Compound Name: | ethyl 4-methyl-2-{2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 327.38 |
| Molecular Formula: | C11 H13 N5 O3 S2 |
| Smiles: | CCOC(c1c(C)nc(NC(CSc2nnc[nH]2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8586 |
| logD: | 0.5041 |
| logSw: | -1.9765 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.918 |
| InChI Key: | DYMZEPHJTGATMP-UHFFFAOYSA-N |