N-methyl-5-{[4-(methylcarbamoyl)-1-phenyl-1H-1,2,3-triazol-5-yl]sulfanyl}-1,2,3-thiadiazole-4-carboxamide
Chemical Structure Depiction of
N-methyl-5-{[4-(methylcarbamoyl)-1-phenyl-1H-1,2,3-triazol-5-yl]sulfanyl}-1,2,3-thiadiazole-4-carboxamide
N-methyl-5-{[4-(methylcarbamoyl)-1-phenyl-1H-1,2,3-triazol-5-yl]sulfanyl}-1,2,3-thiadiazole-4-carboxamide
Compound characteristics
| Compound ID: | Y010-0915 |
| Compound Name: | N-methyl-5-{[4-(methylcarbamoyl)-1-phenyl-1H-1,2,3-triazol-5-yl]sulfanyl}-1,2,3-thiadiazole-4-carboxamide |
| Molecular Weight: | 375.43 |
| Molecular Formula: | C14 H13 N7 O2 S2 |
| Smiles: | CNC(c1c(n(c2ccccc2)nn1)Sc1c(C(NC)=O)nns1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8761 |
| logD: | 0.8761 |
| logSw: | -2.0773 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.368 |
| InChI Key: | NOTUWRUNLZLNQY-UHFFFAOYSA-N |