1-(2H-1,3-benzodioxol-5-yl)-N-({3-ethoxy-4-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl}methyl)methanamine
Chemical Structure Depiction of
1-(2H-1,3-benzodioxol-5-yl)-N-({3-ethoxy-4-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl}methyl)methanamine
1-(2H-1,3-benzodioxol-5-yl)-N-({3-ethoxy-4-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl}methyl)methanamine
Compound characteristics
| Compound ID: | D661-0017 |
| Compound Name: | 1-(2H-1,3-benzodioxol-5-yl)-N-({3-ethoxy-4-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl}methyl)methanamine |
| Molecular Weight: | 481.94 |
| Molecular Formula: | C24 H23 N5 O4 |
| Salt: | HCl |
| Smiles: | CCOc1cc(CNCc2ccc3c(c2)OCO3)ccc1Oc1nnnn1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6161 |
| logD: | -0.1009 |
| logSw: | -3.7635 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.805 |
| InChI Key: | NMUBJKWMVVHXBY-UHFFFAOYSA-N |