3-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyridin-2-yl)ethyl]benzamide
Chemical Structure Depiction of
3-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyridin-2-yl)ethyl]benzamide
3-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyridin-2-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | V003-5278 |
| Compound Name: | 3-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(pyridin-2-yl)ethyl]benzamide |
| Molecular Weight: | 596.8 |
| Molecular Formula: | C34 H40 N6 O2 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1cc(nc(n1)SCc1cccc(c1)C(NCCc1ccccn1)=O)N1CCN(CC1)c1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 6.511 |
| logD: | 6.5103 |
| logSw: | -5.6938 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.778 |
| InChI Key: | DZYQDWNKZPWDIN-UHFFFAOYSA-N |