N~1~-methyl-N~3~-({3-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl}methyl)propane-1,3-diamine--hydrogen chloride (1/2)
Chemical Structure Depiction of
N~1~-methyl-N~3~-({3-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl}methyl)propane-1,3-diamine--hydrogen chloride (1/2)
N~1~-methyl-N~3~-({3-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl}methyl)propane-1,3-diamine--hydrogen chloride (1/2)
Compound characteristics
| Compound ID: | J067-0657 |
| Compound Name: | N~1~-methyl-N~3~-({3-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl}methyl)propane-1,3-diamine--hydrogen chloride (1/2) |
| Molecular Weight: | 411.33 |
| Molecular Formula: | C18 H22 N6 O |
| Salt: | 2HCl |
| Smiles: | CNCCCNCc1cccc(c1)Oc1nnnn1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.6347 |
| logD: | -1.1542 |
| logSw: | -1.8582 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.322 |
| InChI Key: | SXBJKZLHXOZQMI-UHFFFAOYSA-N |