3-[({4-[cyclohexyl(methyl)amino]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-ethylbenzamide
Chemical Structure Depiction of
3-[({4-[cyclohexyl(methyl)amino]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-ethylbenzamide
3-[({4-[cyclohexyl(methyl)amino]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-ethylbenzamide
Compound characteristics
| Compound ID: | V025-7644 |
| Compound Name: | 3-[({4-[cyclohexyl(methyl)amino]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-ethylbenzamide |
| Molecular Weight: | 398.57 |
| Molecular Formula: | C22 H30 N4 O S |
| Salt: | not_available |
| Smiles: | CCNC(c1cccc(CSc2nc(C)cc(n2)N(C)C2CCCCC2)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.392 |
| logD: | 4.3917 |
| logSw: | -4.2402 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.847 |
| InChI Key: | LBUBIOZACWCJOD-UHFFFAOYSA-N |