N-benzyl-1-{3-methoxy-4-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl}methanamine--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-benzyl-1-{3-methoxy-4-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl}methanamine--hydrogen chloride (1/1)
N-benzyl-1-{3-methoxy-4-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl}methanamine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | J067-0061 |
| Compound Name: | N-benzyl-1-{3-methoxy-4-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl}methanamine--hydrogen chloride (1/1) |
| Molecular Weight: | 423.9 |
| Molecular Formula: | C22 H21 N5 O2 |
| Salt: | HCl |
| Smiles: | COc1cc(CNCc2ccccc2)ccc1Oc1nnnn1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5574 |
| logD: | 1.025 |
| logSw: | -3.7918 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.109 |
| InChI Key: | FSAPQUYFWBADRB-UHFFFAOYSA-N |