2-(4-bromophenyl)-5,7-di(propan-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Chemical Structure Depiction of
2-(4-bromophenyl)-5,7-di(propan-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
2-(4-bromophenyl)-5,7-di(propan-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Compound characteristics
| Compound ID: | 3456-0838 |
| Compound Name: | 2-(4-bromophenyl)-5,7-di(propan-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one |
| Molecular Weight: | 391.35 |
| Molecular Formula: | C20 H27 Br N2 O |
| Smiles: | CC(C)C12CN3CC(CN(C1)C3c1ccc(cc1)[Br])(C(C)C)C2=O |
| Stereo: | ACHIRAL |
| logP: | 4.529 |
| logD: | 4.5289 |
| logSw: | -4.2539 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 19.9181 |
| InChI Key: | HKBJPGKLSQRKEF-UHFFFAOYSA-N |