N-(1-benzylpiperidin-4-yl)-3-[({4-chloro-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]benzamide
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-3-[({4-chloro-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]benzamide
N-(1-benzylpiperidin-4-yl)-3-[({4-chloro-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]benzamide
Compound characteristics
| Compound ID: | V001-2961 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-3-[({4-chloro-6-[methyl(propyl)amino]pyrimidin-2-yl}sulfanyl)methyl]benzamide |
| Molecular Weight: | 524.13 |
| Molecular Formula: | C28 H34 Cl N5 O S |
| Salt: | not_available |
| Smiles: | CCCN(C)c1cc(nc(n1)SCc1cccc(c1)C(NC1CCN(CC1)Cc1ccccc1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.4593 |
| logD: | 4.0141 |
| logSw: | -5.8981 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.474 |
| InChI Key: | IXSZJPNRHVXYNW-UHFFFAOYSA-N |