3-[({4-tert-butyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl}sulfanyl)methyl]-N-ethyl-N-methylbenzamide
Chemical Structure Depiction of
3-[({4-tert-butyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl}sulfanyl)methyl]-N-ethyl-N-methylbenzamide
3-[({4-tert-butyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl}sulfanyl)methyl]-N-ethyl-N-methylbenzamide
Compound characteristics
| Compound ID: | V003-6501 |
| Compound Name: | 3-[({4-tert-butyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl}sulfanyl)methyl]-N-ethyl-N-methylbenzamide |
| Molecular Weight: | 454.68 |
| Molecular Formula: | C26 H38 N4 O S |
| Salt: | not_available |
| Smiles: | CCN(C)C(c1cccc(CSc2nc(cc(n2)N(C)C2CCCCC2)C(C)(C)C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9445 |
| logD: | 5.9439 |
| logSw: | -5.2945 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.877 |
| InChI Key: | NWRASMCWAAKJAW-UHFFFAOYSA-N |