4-({[4-(4-acetylpiperazin-1-yl)-6-tert-butylpyrimidin-2-yl]sulfanyl}methyl)-N-[2-(pyridin-2-yl)ethyl]benzamide
Chemical Structure Depiction of
4-({[4-(4-acetylpiperazin-1-yl)-6-tert-butylpyrimidin-2-yl]sulfanyl}methyl)-N-[2-(pyridin-2-yl)ethyl]benzamide
4-({[4-(4-acetylpiperazin-1-yl)-6-tert-butylpyrimidin-2-yl]sulfanyl}methyl)-N-[2-(pyridin-2-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | V003-4478 |
| Compound Name: | 4-({[4-(4-acetylpiperazin-1-yl)-6-tert-butylpyrimidin-2-yl]sulfanyl}methyl)-N-[2-(pyridin-2-yl)ethyl]benzamide |
| Molecular Weight: | 532.71 |
| Molecular Formula: | C29 H36 N6 O2 S |
| Salt: | not_available |
| Smiles: | CC(N1CCN(CC1)c1cc(C(C)(C)C)nc(n1)SCc1ccc(cc1)C(NCCc1ccccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.122 |
| logD: | 4.1214 |
| logSw: | -4.1435 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.17 |
| InChI Key: | VUNPXLWFSKWXEU-UHFFFAOYSA-N |