N-[(5-bromo-2-methoxyphenyl)methyl]-3-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]propan-1-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-3-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]propan-1-amine--hydrogen chloride (1/1)
N-[(5-bromo-2-methoxyphenyl)methyl]-3-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]propan-1-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D272-0544 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-3-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]propan-1-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 408.75 |
| Molecular Formula: | C13 H18 Br N5 O S |
| Salt: | HCl |
| Smiles: | [H]N(CCCSc1nnnn1C)Cc1cc(ccc1OC)[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.9144 |
| logD: | -0.3043 |
| logSw: | -2.5103 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.819 |
| InChI Key: | KUZQJIOIXSCANM-UHFFFAOYSA-N |