6,7-dimethoxy-3,3-dimethyl-1-(nitromethylidene)-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
6,7-dimethoxy-3,3-dimethyl-1-(nitromethylidene)-1,2,3,4-tetrahydroisoquinoline
6,7-dimethoxy-3,3-dimethyl-1-(nitromethylidene)-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | 8013-2411 |
| Compound Name: | 6,7-dimethoxy-3,3-dimethyl-1-(nitromethylidene)-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 278.31 |
| Molecular Formula: | C14 H18 N2 O4 |
| Smiles: | CC1(C)Cc2cc(c(cc2/C(=C/[N+]([O-])=O)N1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 1.7012 |
| logD: | 1.7011 |
| logSw: | -2.4034 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.78 |
| InChI Key: | ILPRHKWBHQJWMR-UHFFFAOYSA-N |