N-({2-[(2-fluorophenyl)methoxy]naphthalen-1-yl}methyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-({2-[(2-fluorophenyl)methoxy]naphthalen-1-yl}methyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
N-({2-[(2-fluorophenyl)methoxy]naphthalen-1-yl}methyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D175-0029 |
| Compound Name: | N-({2-[(2-fluorophenyl)methoxy]naphthalen-1-yl}methyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 459.97 |
| Molecular Formula: | C22 H22 F N5 O S |
| Salt: | HCl |
| Smiles: | [H]N(CCSc1nnnn1C)Cc1c(ccc2ccccc12)OCc1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 3.6474 |
| logD: | 1.4907 |
| logSw: | -4.1305 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.232 |
| InChI Key: | NYPYSZABGFCOPZ-UHFFFAOYSA-N |