ethyl 5-{[1-(2-aminophenyl)-4-(dimethylcarbamoyl)-1H-1,2,3-triazol-5-yl]sulfanyl}-1,2,3-thiadiazole-4-carboxylate
Chemical Structure Depiction of
ethyl 5-{[1-(2-aminophenyl)-4-(dimethylcarbamoyl)-1H-1,2,3-triazol-5-yl]sulfanyl}-1,2,3-thiadiazole-4-carboxylate
ethyl 5-{[1-(2-aminophenyl)-4-(dimethylcarbamoyl)-1H-1,2,3-triazol-5-yl]sulfanyl}-1,2,3-thiadiazole-4-carboxylate
Compound characteristics
| Compound ID: | Y010-1237 |
| Compound Name: | ethyl 5-{[1-(2-aminophenyl)-4-(dimethylcarbamoyl)-1H-1,2,3-triazol-5-yl]sulfanyl}-1,2,3-thiadiazole-4-carboxylate |
| Molecular Weight: | 419.48 |
| Molecular Formula: | C16 H17 N7 O3 S2 |
| Smiles: | CCOC(c1c(Sc2c(C(N(C)C)=O)nnn2c2ccccc2N)snn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3861 |
| logD: | 1.3858 |
| logSw: | -2.1229 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.247 |
| InChI Key: | YURWSORLJGFTEY-UHFFFAOYSA-N |