ethyl 2-(2-{[5-(2-amino-4-methyl-1,3-thiazol-5-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-(2-{[5-(2-amino-4-methyl-1,3-thiazol-5-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-(2-{[5-(2-amino-4-methyl-1,3-thiazol-5-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | C592-3882 |
| Compound Name: | ethyl 2-(2-{[5-(2-amino-4-methyl-1,3-thiazol-5-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 453.56 |
| Molecular Formula: | C16 H19 N7 O3 S3 |
| Smiles: | CCOC(c1c(C)nc(NC(CSc2nnc(c3c(C)nc(N)s3)n2C)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3281 |
| logD: | 2.2615 |
| logSw: | -2.521 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 110.957 |
| InChI Key: | FWRYDFFUWARPER-UHFFFAOYSA-N |