(3-nitrophenyl)(1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-yl)methanone
Chemical Structure Depiction of
(3-nitrophenyl)(1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-yl)methanone
(3-nitrophenyl)(1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-yl)methanone
Compound characteristics
| Compound ID: | 1307-0042 |
| Compound Name: | (3-nitrophenyl)(1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-yl)methanone |
| Molecular Weight: | 288.3 |
| Molecular Formula: | C14 H16 N4 O3 |
| Smiles: | C1C2(CN3CN1CN(C2)C3)C(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6642 |
| logD: | 1.6623 |
| logSw: | -2.3171 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 58.878 |
| InChI Key: | IGZHOJVHMBULCK-UHFFFAOYSA-N |