ethyl 1-(2-aminophenyl)-5-{[4-(methylcarbamoyl)-1,2,3-thiadiazol-5-yl]sulfanyl}-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(2-aminophenyl)-5-{[4-(methylcarbamoyl)-1,2,3-thiadiazol-5-yl]sulfanyl}-1H-1,2,3-triazole-4-carboxylate
ethyl 1-(2-aminophenyl)-5-{[4-(methylcarbamoyl)-1,2,3-thiadiazol-5-yl]sulfanyl}-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | Y010-0720 |
| Compound Name: | ethyl 1-(2-aminophenyl)-5-{[4-(methylcarbamoyl)-1,2,3-thiadiazol-5-yl]sulfanyl}-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 405.45 |
| Molecular Formula: | C15 H15 N7 O3 S2 |
| Smiles: | CCOC(c1c(n(c2ccccc2N)nn1)Sc1c(C(NC)=O)nns1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5658 |
| logD: | 1.5655 |
| logSw: | -2.2474 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 115.081 |
| InChI Key: | OOHYQRJPJJOLHU-UHFFFAOYSA-N |