ethyl 2-{2-[(3-amino-1H-1,2,4-triazol-5-yl)sulfanyl]acetamido}-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[(3-amino-1H-1,2,4-triazol-5-yl)sulfanyl]acetamido}-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-{2-[(3-amino-1H-1,2,4-triazol-5-yl)sulfanyl]acetamido}-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | 8019-5852 |
| Compound Name: | ethyl 2-{2-[(3-amino-1H-1,2,4-triazol-5-yl)sulfanyl]acetamido}-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 342.4 |
| Molecular Formula: | C11 H14 N6 O3 S2 |
| Smiles: | CCOC(c1c(C)nc(NC(CSc2nc(N)n[nH]2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0165 |
| logD: | 0.9741 |
| logSw: | -1.7428 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 107.738 |
| InChI Key: | TWXXYWQRYCPGIL-UHFFFAOYSA-N |