3,4,5-trimethoxy-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}benzamide
Chemical Structure Depiction of
3,4,5-trimethoxy-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}benzamide
3,4,5-trimethoxy-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}benzamide
Compound characteristics
| Compound ID: | C095-0396 |
| Compound Name: | 3,4,5-trimethoxy-N-{4-methyl-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinolin-6-yl}benzamide |
| Molecular Weight: | 514.58 |
| Molecular Formula: | C28 H30 N6 O4 |
| Smiles: | Cc1cc(nc2ccc(cc12)NC(c1cc(c(c(c1)OC)OC)OC)=O)N1CCN(CC1)c1ncccn1 |
| Stereo: | ACHIRAL |
| logP: | 5.0699 |
| logD: | 5.0697 |
| logSw: | -4.8585 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.177 |
| InChI Key: | DEVHQDDOSCURKT-UHFFFAOYSA-N |