3-[2-(benzylamino)prop-1-en-1-yl]-N-(3-chloro-4-fluorophenyl)-1,2,4-thiadiazol-5-amine
Chemical Structure Depiction of
3-[2-(benzylamino)prop-1-en-1-yl]-N-(3-chloro-4-fluorophenyl)-1,2,4-thiadiazol-5-amine
3-[2-(benzylamino)prop-1-en-1-yl]-N-(3-chloro-4-fluorophenyl)-1,2,4-thiadiazol-5-amine
Compound characteristics
| Compound ID: | C120-0023 |
| Compound Name: | 3-[2-(benzylamino)prop-1-en-1-yl]-N-(3-chloro-4-fluorophenyl)-1,2,4-thiadiazol-5-amine |
| Molecular Weight: | 374.87 |
| Molecular Formula: | C18 H16 Cl F N4 S |
| Smiles: | C/C(=C\c1nc(Nc2ccc(c(c2)[Cl])F)sn1)NCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3398 |
| logD: | 5.3397 |
| logSw: | -5.9676 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 39.88 |
| InChI Key: | FJRIRMILFGAJFZ-UHFFFAOYSA-N |