1-C-[6-oxo-5,7-di(propan-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-2-yl]pentitol
Chemical Structure Depiction of
1-C-[6-oxo-5,7-di(propan-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-2-yl]pentitol
1-C-[6-oxo-5,7-di(propan-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-2-yl]pentitol
Compound characteristics
| Compound ID: | 5504-0439 |
| Compound Name: | 1-C-[6-oxo-5,7-di(propan-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-2-yl]pentitol |
| Molecular Weight: | 386.49 |
| Molecular Formula: | C19 H34 N2 O6 |
| Smiles: | CC(C)C12CN3CC(CN(C1)C3C(C(C(C(CO)O)O)O)O)(C(C)C)C2=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | -0.4581 |
| logD: | -0.4582 |
| logSw: | 0.0931 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 100.511 |
| InChI Key: | WOPHSSJTAPPKNL-UHFFFAOYSA-N |