N-{3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl}-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-{3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl}-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
N-{3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl}-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | E715-0182 |
| Compound Name: | N-{3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl}-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide |
| Molecular Weight: | 546.72 |
| Molecular Formula: | C30 H42 N8 O2 |
| Smiles: | COc1ccccc1N1CCN(CCCNC(C2CCCN(C2)c2c3c(ncn2)n2CCCCCc2n3)=O)CC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9505 |
| logD: | 2.5413 |
| logSw: | -3.2226 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.356 |
| InChI Key: | NIWOGJIJEBWLEP-QHCPKHFHSA-N |