1-{4-[4-(6,7,8,9-tetrahydropyrido[1,2-e]purin-4-yl)piperazin-1-yl]phenyl}ethan-1-one
Chemical Structure Depiction of
1-{4-[4-(6,7,8,9-tetrahydropyrido[1,2-e]purin-4-yl)piperazin-1-yl]phenyl}ethan-1-one
1-{4-[4-(6,7,8,9-tetrahydropyrido[1,2-e]purin-4-yl)piperazin-1-yl]phenyl}ethan-1-one
Compound characteristics
| Compound ID: | E715-1049 |
| Compound Name: | 1-{4-[4-(6,7,8,9-tetrahydropyrido[1,2-e]purin-4-yl)piperazin-1-yl]phenyl}ethan-1-one |
| Molecular Weight: | 376.46 |
| Molecular Formula: | C21 H24 N6 O |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)c1c2c(ncn1)n1CCCCc1n2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7374 |
| logD: | 2.7316 |
| logSw: | -2.8687 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.352 |
| InChI Key: | AAXCBEJOJWCJEE-UHFFFAOYSA-N |