3-({[4-(methoxymethyl)-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[2-(morpholin-4-yl)ethyl]benzamide
Chemical Structure Depiction of
3-({[4-(methoxymethyl)-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[2-(morpholin-4-yl)ethyl]benzamide
3-({[4-(methoxymethyl)-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[2-(morpholin-4-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | V017-8581 |
| Compound Name: | 3-({[4-(methoxymethyl)-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[2-(morpholin-4-yl)ethyl]benzamide |
| Molecular Weight: | 500.66 |
| Molecular Formula: | C25 H36 N6 O3 S |
| Smiles: | CN1CCN(CC1)c1cc(COC)nc(n1)SCc1cccc(c1)C(NCCN1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.995 |
| logD: | 1.425 |
| logSw: | -2.534 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.718 |
| InChI Key: | HNDOGSLUHCAPAI-UHFFFAOYSA-N |