(7-hydroxy-1-methyl-2,3,4,5,6,7-hexahydro-1H-1-benzazonin-9-yl)[4-(prop-2-en-1-yl)piperazin-1-yl]methanone
Chemical Structure Depiction of
(7-hydroxy-1-methyl-2,3,4,5,6,7-hexahydro-1H-1-benzazonin-9-yl)[4-(prop-2-en-1-yl)piperazin-1-yl]methanone
(7-hydroxy-1-methyl-2,3,4,5,6,7-hexahydro-1H-1-benzazonin-9-yl)[4-(prop-2-en-1-yl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | S768-0109 |
| Compound Name: | (7-hydroxy-1-methyl-2,3,4,5,6,7-hexahydro-1H-1-benzazonin-9-yl)[4-(prop-2-en-1-yl)piperazin-1-yl]methanone |
| Molecular Weight: | 357.5 |
| Molecular Formula: | C21 H31 N3 O2 |
| Smiles: | CN1CCCCCC(c2cc(ccc12)C(N1CCN(CC1)CC=C)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8922 |
| logD: | 1.8512 |
| logSw: | -2.6192 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.173 |
| InChI Key: | YYEXKVHPSBBVMF-FQEVSTJZSA-N |