N-[([1,1'-biphenyl]-4-yl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[([1,1'-biphenyl]-4-yl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
N-[([1,1'-biphenyl]-4-yl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D660-0299 |
| Compound Name: | N-[([1,1'-biphenyl]-4-yl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 423.97 |
| Molecular Formula: | C22 H21 N5 S |
| Salt: | HCl |
| Smiles: | [H]N(CCSc1nnnn1c1ccccc1)Cc1ccc(cc1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2015 |
| logD: | 1.8565 |
| logSw: | -4.5171 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.496 |
| InChI Key: | JSEJGEUQKQTLSP-UHFFFAOYSA-N |