N-(3-chloro-4-fluorophenyl)-3-[2-(4-methylpiperidin-1-yl)prop-1-en-1-yl]-1,2,4-thiadiazol-5-amine
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-3-[2-(4-methylpiperidin-1-yl)prop-1-en-1-yl]-1,2,4-thiadiazol-5-amine
N-(3-chloro-4-fluorophenyl)-3-[2-(4-methylpiperidin-1-yl)prop-1-en-1-yl]-1,2,4-thiadiazol-5-amine
Compound characteristics
| Compound ID: | C120-0021 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-3-[2-(4-methylpiperidin-1-yl)prop-1-en-1-yl]-1,2,4-thiadiazol-5-amine |
| Molecular Weight: | 366.89 |
| Molecular Formula: | C17 H20 Cl F N4 S |
| Smiles: | CC1CCN(CC1)C(\C)=C\c1nc(Nc2ccc(c(c2)[Cl])F)sn1 |
| Stereo: | ACHIRAL |
| logP: | 5.6078 |
| logD: | 5.5978 |
| logSw: | -6.0197 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.71 |
| InChI Key: | VPYUCNQZRXUSDT-UHFFFAOYSA-N |