3,4,5-triethoxy-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}benzamide
Chemical Structure Depiction of
3,4,5-triethoxy-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}benzamide
3,4,5-triethoxy-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}benzamide
Compound characteristics
| Compound ID: | C095-0468 |
| Compound Name: | 3,4,5-triethoxy-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}benzamide |
| Molecular Weight: | 556.67 |
| Molecular Formula: | C31 H36 N6 O4 |
| Smiles: | CCOc1cc(cc(c1OCC)OCC)C(Nc1ccc2c(c1)c(C)cc(n2)N1CCN(CC1)c1ncccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0287 |
| logD: | 6.0285 |
| logSw: | -5.4966 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.916 |
| InChI Key: | LZLFJGHQMWZQDM-UHFFFAOYSA-N |