N-[(2,3-dimethoxyphenyl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[(2,3-dimethoxyphenyl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
N-[(2,3-dimethoxyphenyl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D272-0211 |
| Compound Name: | N-[(2,3-dimethoxyphenyl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 407.92 |
| Molecular Formula: | C18 H21 N5 O2 S |
| Salt: | HCl |
| Smiles: | [H]N(CCSc1nnnn1c1ccccc1)Cc1cccc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.589 |
| logD: | -1.4315 |
| logSw: | -2.9131 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.115 |
| InChI Key: | ZRKXMGHFBXZIGX-UHFFFAOYSA-N |