4-tert-butyl-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}benzamide
Chemical Structure Depiction of
4-tert-butyl-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}benzamide
4-tert-butyl-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}benzamide
Compound characteristics
| Compound ID: | C095-0395 |
| Compound Name: | 4-tert-butyl-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}benzamide |
| Molecular Weight: | 480.61 |
| Molecular Formula: | C29 H32 N6 O |
| Smiles: | Cc1cc(nc2ccc(cc12)NC(c1ccc(cc1)C(C)(C)C)=O)N1CCN(CC1)c1ncccn1 |
| Stereo: | ACHIRAL |
| logP: | 7.0836 |
| logD: | 7.0815 |
| logSw: | -5.6644 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.199 |
| InChI Key: | XHWXZBPDJXRNCH-UHFFFAOYSA-N |