N-[(3,5-dibromo-2-methoxyphenyl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine
Chemical Structure Depiction of
N-[(3,5-dibromo-2-methoxyphenyl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine
N-[(3,5-dibromo-2-methoxyphenyl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine
Compound characteristics
| Compound ID: | D660-0317 |
| Compound Name: | N-[(3,5-dibromo-2-methoxyphenyl)methyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine |
| Molecular Weight: | 535.69 |
| Molecular Formula: | C17 H17 Br2 N5 O S |
| Salt: | HCl |
| Smiles: | [H]N(CCSc1nnnn1c1ccccc1)Cc1cc(cc(c1OC)[Br])[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.2547 |
| logD: | 1.6799 |
| logSw: | -4.2616 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.485 |
| InChI Key: | FLEWNNSBGWOGIC-UHFFFAOYSA-N |