N-[(5-bromo-2-methoxyphenyl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
N-[(5-bromo-2-methoxyphenyl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D272-0152 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 456.79 |
| Molecular Formula: | C17 H18 Br N5 O S |
| Salt: | HCl |
| Smiles: | [H]N(CCSc1nnnn1c1ccccc1)Cc1cc(ccc1OC)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.3414 |
| logD: | 0.7666 |
| logSw: | -3.5562 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.398 |
| InChI Key: | DVSBSJRUGADLHB-UHFFFAOYSA-N |