3-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-3,6,7,8,9,10-hexahydro-4H-azepino[1,2-e]purin-4-one
Chemical Structure Depiction of
3-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-3,6,7,8,9,10-hexahydro-4H-azepino[1,2-e]purin-4-one
3-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-3,6,7,8,9,10-hexahydro-4H-azepino[1,2-e]purin-4-one
Compound characteristics
| Compound ID: | E714-0325 |
| Compound Name: | 3-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-3,6,7,8,9,10-hexahydro-4H-azepino[1,2-e]purin-4-one |
| Molecular Weight: | 412.53 |
| Molecular Formula: | C22 H32 N6 O2 |
| Smiles: | C1CCC(CC1)N1CCN(CC1)C(CN1C=Nc2c(C1=O)nc1CCCCCn12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5904 |
| logD: | 1.428 |
| logSw: | -1.6924 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.614 |
| InChI Key: | NZYYOQHJWVNPNZ-UHFFFAOYSA-N |