N'-(3-chloro-4-fluorophenyl)-N-(3-methylbutyl)-N-[1-(pyridin-2-yl)ethyl]thiourea
Chemical Structure Depiction of
N'-(3-chloro-4-fluorophenyl)-N-(3-methylbutyl)-N-[1-(pyridin-2-yl)ethyl]thiourea
N'-(3-chloro-4-fluorophenyl)-N-(3-methylbutyl)-N-[1-(pyridin-2-yl)ethyl]thiourea
Compound characteristics
| Compound ID: | K788-0778 |
| Compound Name: | N'-(3-chloro-4-fluorophenyl)-N-(3-methylbutyl)-N-[1-(pyridin-2-yl)ethyl]thiourea |
| Molecular Weight: | 379.93 |
| Molecular Formula: | C19 H23 Cl F N3 S |
| Smiles: | CC(C)CCN(C(C)c1ccccn1)C(Nc1ccc(c(c1)[Cl])F)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4117 |
| logD: | 5.4116 |
| logSw: | -6.028 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 19.0896 |
| InChI Key: | NFSYGDYBZLMTTR-AWEZNQCLSA-N |