5-{[4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-N-(1,3-dimethyl-1H-pyrazol-4-yl)-1,3,4-thiadiazol-2-amine
Chemical Structure Depiction of
5-{[4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-N-(1,3-dimethyl-1H-pyrazol-4-yl)-1,3,4-thiadiazol-2-amine
5-{[4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-N-(1,3-dimethyl-1H-pyrazol-4-yl)-1,3,4-thiadiazol-2-amine
Compound characteristics
| Compound ID: | Y500-4456 |
| Compound Name: | 5-{[4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-N-(1,3-dimethyl-1H-pyrazol-4-yl)-1,3,4-thiadiazol-2-amine |
| Molecular Weight: | 391.8 |
| Molecular Formula: | C13 H13 Cl F3 N7 S |
| Smiles: | Cc1c(cn(C)n1)Nc1nnc(Cn2c(C)c(c(C(F)(F)F)n2)[Cl])s1 |
| Stereo: | ACHIRAL |
| logP: | 2.3556 |
| logD: | 2.3556 |
| logSw: | -3.5805 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.131 |
| InChI Key: | SSHCBYIWVMNTHW-UHFFFAOYSA-N |