4-({[4-(4-ethylpiperazin-1-yl)-6-(propan-2-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide
Chemical Structure Depiction of
4-({[4-(4-ethylpiperazin-1-yl)-6-(propan-2-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide
4-({[4-(4-ethylpiperazin-1-yl)-6-(propan-2-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide
Compound characteristics
| Compound ID: | V025-3224 |
| Compound Name: | 4-({[4-(4-ethylpiperazin-1-yl)-6-(propan-2-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide |
| Molecular Weight: | 455.67 |
| Molecular Formula: | C25 H37 N5 O S |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)c1cc(C(C)C)nc(n1)SCc1ccc(cc1)C(NCC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8437 |
| logD: | 4.1563 |
| logSw: | -4.4856 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.398 |
| InChI Key: | CHIGHZMJJBXSBQ-UHFFFAOYSA-N |