N-(3-chloro-4-fluorophenyl)-3-{2-[(2-phenylethyl)amino]prop-1-en-1-yl}-1,2,4-thiadiazol-5-amine
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-3-{2-[(2-phenylethyl)amino]prop-1-en-1-yl}-1,2,4-thiadiazol-5-amine
N-(3-chloro-4-fluorophenyl)-3-{2-[(2-phenylethyl)amino]prop-1-en-1-yl}-1,2,4-thiadiazol-5-amine
Compound characteristics
| Compound ID: | C120-0034 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-3-{2-[(2-phenylethyl)amino]prop-1-en-1-yl}-1,2,4-thiadiazol-5-amine |
| Molecular Weight: | 388.89 |
| Molecular Formula: | C19 H18 Cl F N4 S |
| Smiles: | C/C(=C\c1nc(Nc2ccc(c(c2)[Cl])F)sn1)NCCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5043 |
| logD: | 5.4994 |
| logSw: | -5.9723 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 39.721 |
| InChI Key: | IVJPIBLNSYSMOB-UHFFFAOYSA-N |