3-[({4-tert-butyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-3-yl)methyl]benzamide
Chemical Structure Depiction of
3-[({4-tert-butyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-3-yl)methyl]benzamide
3-[({4-tert-butyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-3-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V025-5435 |
| Compound Name: | 3-[({4-tert-butyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-3-yl)methyl]benzamide |
| Molecular Weight: | 503.71 |
| Molecular Formula: | C29 H37 N5 O S |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1cc(nc(n1)SCc1cccc(c1)C(NCc1cccnc1)=O)N(C)C1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 5.9445 |
| logD: | 5.9439 |
| logSw: | -5.0955 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.661 |
| InChI Key: | XIRJGYAYWSKGTH-UHFFFAOYSA-N |