N-(1-acetylpiperidin-4-yl)-N'-(3-chloro-4-fluorophenyl)-N-{3-[(propan-2-yl)oxy]propyl}thiourea
Chemical Structure Depiction of
N-(1-acetylpiperidin-4-yl)-N'-(3-chloro-4-fluorophenyl)-N-{3-[(propan-2-yl)oxy]propyl}thiourea
N-(1-acetylpiperidin-4-yl)-N'-(3-chloro-4-fluorophenyl)-N-{3-[(propan-2-yl)oxy]propyl}thiourea
Compound characteristics
| Compound ID: | K786-9914 |
| Compound Name: | N-(1-acetylpiperidin-4-yl)-N'-(3-chloro-4-fluorophenyl)-N-{3-[(propan-2-yl)oxy]propyl}thiourea |
| Molecular Weight: | 429.98 |
| Molecular Formula: | C20 H29 Cl F N3 O2 S |
| Smiles: | CC(C)OCCCN(C1CCN(CC1)C(C)=O)C(Nc1ccc(c(c1)[Cl])F)=S |
| Stereo: | ACHIRAL |
| logP: | 3.9838 |
| logD: | 3.9837 |
| logSw: | -4.2794 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.319 |
| InChI Key: | LHHFKWCYGZFOOV-UHFFFAOYSA-N |