5,7-dimethyl-2-(3-nitrophenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decane
Chemical Structure Depiction of
5,7-dimethyl-2-(3-nitrophenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decane
5,7-dimethyl-2-(3-nitrophenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decane
Compound characteristics
| Compound ID: | D171-0084 |
| Compound Name: | 5,7-dimethyl-2-(3-nitrophenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decane |
| Molecular Weight: | 287.36 |
| Molecular Formula: | C16 H21 N3 O2 |
| Smiles: | CC12CC3(C)CN(C1)C(c1cccc(c1)[N+]([O-])=O)N(C2)C3 |
| Stereo: | ACHIRAL |
| logP: | 2.7385 |
| logD: | 2.5547 |
| logSw: | -2.9876 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.153 |
| InChI Key: | FYJAYBVWBPRWAH-UHFFFAOYSA-N |