N-{[4-(methylsulfanyl)phenyl]methyl}-4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline
Chemical Structure Depiction of
N-{[4-(methylsulfanyl)phenyl]methyl}-4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline
N-{[4-(methylsulfanyl)phenyl]methyl}-4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline
Compound characteristics
| Compound ID: | 8016-8093 |
| Compound Name: | N-{[4-(methylsulfanyl)phenyl]methyl}-4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline |
| Molecular Weight: | 367.49 |
| Molecular Formula: | C18 H17 N5 S2 |
| Smiles: | [H]N(Cc1ccc(cc1)SC)c1ccc(cc1)c1nn2c(C)nnc2s1 |
| Stereo: | ACHIRAL |
| logP: | 3.5021 |
| logD: | 3.5021 |
| logSw: | -3.6501 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.005 |
| InChI Key: | PNXMGGCCHZJMCB-UHFFFAOYSA-N |