N-[(3-chloro-4-fluorophenyl)methyl]-3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl}propanamide
Chemical Structure Depiction of
N-[(3-chloro-4-fluorophenyl)methyl]-3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl}propanamide
N-[(3-chloro-4-fluorophenyl)methyl]-3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl}propanamide
Compound characteristics
| Compound ID: | T422-0203 |
| Compound Name: | N-[(3-chloro-4-fluorophenyl)methyl]-3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl}propanamide |
| Molecular Weight: | 419.93 |
| Molecular Formula: | C21 H27 Cl F N5 O |
| Smiles: | CCNc1cc(ncn1)N1CCC(CCC(NCc2ccc(c(c2)[Cl])F)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.4013 |
| logD: | 4.3895 |
| logSw: | -4.54 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.863 |
| InChI Key: | WLACDTUMRIWTBF-UHFFFAOYSA-N |