{4-[({4-[cyclohexyl(methyl)amino]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]phenyl}(4-methylpiperazin-1-yl)methanone
Chemical Structure Depiction of
{4-[({4-[cyclohexyl(methyl)amino]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]phenyl}(4-methylpiperazin-1-yl)methanone
{4-[({4-[cyclohexyl(methyl)amino]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]phenyl}(4-methylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V027-2474 |
| Compound Name: | {4-[({4-[cyclohexyl(methyl)amino]-6-ethylpyrimidin-2-yl}sulfanyl)methyl]phenyl}(4-methylpiperazin-1-yl)methanone |
| Molecular Weight: | 467.68 |
| Molecular Formula: | C26 H37 N5 O S |
| Salt: | not_available |
| Smiles: | CCc1cc(nc(n1)SCc1ccc(cc1)C(N1CCN(C)CC1)=O)N(C)C1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.2917 |
| logD: | 4.161 |
| logSw: | -4.168 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.35 |
| InChI Key: | LHDBLZAXWNIYEH-UHFFFAOYSA-N |