5,7-diethyl-2-(3-nitrophenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-ol
Chemical Structure Depiction of
5,7-diethyl-2-(3-nitrophenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-ol
5,7-diethyl-2-(3-nitrophenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-ol
Compound characteristics
| Compound ID: | D318-0223 |
| Compound Name: | 5,7-diethyl-2-(3-nitrophenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-ol |
| Molecular Weight: | 331.41 |
| Molecular Formula: | C18 H25 N3 O3 |
| Smiles: | CCC12CN3CC(CC)(CN(C1)C3c1cccc(c1)[N+]([O-])=O)C2O |
| Stereo: | ACHIRAL |
| logP: | 2.265 |
| logD: | 1.9699 |
| logSw: | -2.4105 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.663 |
| InChI Key: | XDGBLOVNEBZCAM-UHFFFAOYSA-N |