4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-(methoxymethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyridin-2-yl)ethyl]benzamide
Chemical Structure Depiction of
4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-(methoxymethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyridin-2-yl)ethyl]benzamide
4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-(methoxymethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyridin-2-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | V004-6499 |
| Compound Name: | 4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-(methoxymethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyridin-2-yl)ethyl]benzamide |
| Molecular Weight: | 572.71 |
| Molecular Formula: | C31 H33 F N6 O2 S |
| Salt: | not_available |
| Smiles: | COCc1cc(nc(n1)SCc1ccc(cc1)C(NCCc1ccccn1)=O)N1CCN(CC1)c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 4.652 |
| logD: | 4.6518 |
| logSw: | -4.3829 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.853 |
| InChI Key: | ZVDVSCBHECCTLX-UHFFFAOYSA-N |