N-(1-benzyl-1H-pyrazol-3-yl)-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-1,3,4-thiadiazol-2-amine
Chemical Structure Depiction of
N-(1-benzyl-1H-pyrazol-3-yl)-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-1,3,4-thiadiazol-2-amine
N-(1-benzyl-1H-pyrazol-3-yl)-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-1,3,4-thiadiazol-2-amine
Compound characteristics
| Compound ID: | Y503-1880 |
| Compound Name: | N-(1-benzyl-1H-pyrazol-3-yl)-5-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-1,3,4-thiadiazol-2-amine |
| Molecular Weight: | 419.43 |
| Molecular Formula: | C18 H16 F3 N7 S |
| Smiles: | Cc1cc(C(F)(F)F)nn1Cc1nnc(Nc2ccn(Cc3ccccc3)n2)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.5255 |
| logD: | 3.5251 |
| logSw: | -3.6711 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.076 |
| InChI Key: | AQTKXXCLEHSQOH-UHFFFAOYSA-N |