4-({[4-(4-acetylpiperazin-1-yl)-6-ethylpyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-2-yl)methyl]benzamide
Chemical Structure Depiction of
4-({[4-(4-acetylpiperazin-1-yl)-6-ethylpyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-2-yl)methyl]benzamide
4-({[4-(4-acetylpiperazin-1-yl)-6-ethylpyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V014-4359 |
| Compound Name: | 4-({[4-(4-acetylpiperazin-1-yl)-6-ethylpyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-2-yl)methyl]benzamide |
| Molecular Weight: | 490.63 |
| Molecular Formula: | C26 H30 N6 O2 S |
| Salt: | not_available |
| Smiles: | CCc1cc(nc(n1)SCc1ccc(cc1)C(NCc1ccccn1)=O)N1CCN(CC1)C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3648 |
| logD: | 3.3644 |
| logSw: | -3.5214 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.823 |
| InChI Key: | VQNVOLQBTUYELQ-UHFFFAOYSA-N |