[7-hydroxy-1-(2-methoxyethyl)-2,3,4,5,6,7-hexahydro-1H-1-benzazonin-9-yl][4-(pyrimidin-2-yl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[7-hydroxy-1-(2-methoxyethyl)-2,3,4,5,6,7-hexahydro-1H-1-benzazonin-9-yl][4-(pyrimidin-2-yl)piperazin-1-yl]methanone
[7-hydroxy-1-(2-methoxyethyl)-2,3,4,5,6,7-hexahydro-1H-1-benzazonin-9-yl][4-(pyrimidin-2-yl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | S768-0322 |
| Compound Name: | [7-hydroxy-1-(2-methoxyethyl)-2,3,4,5,6,7-hexahydro-1H-1-benzazonin-9-yl][4-(pyrimidin-2-yl)piperazin-1-yl]methanone |
| Molecular Weight: | 439.56 |
| Molecular Formula: | C24 H33 N5 O3 |
| Smiles: | COCCN1CCCCCC(c2cc(ccc12)C(N1CCN(CC1)c1ncccn1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7251 |
| logD: | 2.725 |
| logSw: | -3.1242 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.611 |
| InChI Key: | PFQPIMWNSRQUIK-QFIPXVFZSA-N |