4-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(morpholin-4-yl)ethyl]benzamide
Chemical Structure Depiction of
4-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(morpholin-4-yl)ethyl]benzamide
4-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(morpholin-4-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | V016-0185 |
| Compound Name: | 4-[({4-tert-butyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)methyl]-N-[2-(morpholin-4-yl)ethyl]benzamide |
| Molecular Weight: | 604.82 |
| Molecular Formula: | C33 H44 N6 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1cc(nc(n1)SCc1ccc(cc1)C(NCCN1CCOCC1)=O)N1CCN(CC1)c1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 5.2658 |
| logD: | 5.2517 |
| logSw: | -5.0799 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.126 |
| InChI Key: | AYCZDJPPHAXFPJ-UHFFFAOYSA-N |