3-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-ethylbenzamide
Chemical Structure Depiction of
3-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-ethylbenzamide
3-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-ethylbenzamide
Compound characteristics
| Compound ID: | V003-5302 |
| Compound Name: | 3-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-ethylbenzamide |
| Molecular Weight: | 519.71 |
| Molecular Formula: | C29 H37 N5 O2 S |
| Salt: | not_available |
| Smiles: | CCNC(c1cccc(CSc2nc(cc(n2)N2CCN(CC2)c2ccc(cc2)OC)C(C)(C)C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1247 |
| logD: | 6.1241 |
| logSw: | -5.489 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.291 |
| InChI Key: | LFUYBSXXSXCIHC-UHFFFAOYSA-N |