N-[(2-ethoxynaphthalen-1-yl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[(2-ethoxynaphthalen-1-yl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
N-[(2-ethoxynaphthalen-1-yl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | D660-0294 |
Compound Name: | N-[(2-ethoxynaphthalen-1-yl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1) |
Molecular Weight: | 441.98 |
Molecular Formula: | C22 H23 N5 O S |
Salt: | HCl |
Smiles: | [H]N(CCSc1nnnn1c1ccccc1)Cc1c(ccc2ccccc12)OCC |
Stereo: | ACHIRAL |
logP: | 3.9966 |
logD: | 1.48 |
logSw: | -4.2695 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.706 |
InChI Key: | RJMPHOOZKRLUPD-UHFFFAOYSA-N |