1-(2H-1,3-benzodioxol-5-yl)-N-({3-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl}methyl)methanamine--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-(2H-1,3-benzodioxol-5-yl)-N-({3-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl}methyl)methanamine--hydrogen chloride (1/1)
1-(2H-1,3-benzodioxol-5-yl)-N-({3-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl}methyl)methanamine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | J067-0325 |
| Compound Name: | 1-(2H-1,3-benzodioxol-5-yl)-N-({3-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl}methyl)methanamine--hydrogen chloride (1/1) |
| Molecular Weight: | 437.88 |
| Molecular Formula: | C22 H19 N5 O3 |
| Salt: | HCl |
| Smiles: | C(c1cccc(c1)Oc1nnnn1c1ccccc1)NCc1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 3.6363 |
| logD: | 0.5808 |
| logSw: | -4.018 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.508 |
| InChI Key: | NRBKKZALIPTOCA-UHFFFAOYSA-N |