2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]-N-({4-[(thiophen-2-yl)methoxy]phenyl}methyl)ethan-1-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]-N-({4-[(thiophen-2-yl)methoxy]phenyl}methyl)ethan-1-amine--hydrogen chloride (1/1)
2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]-N-({4-[(thiophen-2-yl)methoxy]phenyl}methyl)ethan-1-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D272-0265 |
| Compound Name: | 2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]-N-({4-[(thiophen-2-yl)methoxy]phenyl}methyl)ethan-1-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 460.02 |
| Molecular Formula: | C21 H21 N5 O S2 |
| Salt: | HCl |
| Smiles: | [H]N(CCSc1nnnn1c1ccccc1)Cc1ccc(cc1)OCc1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 3.5793 |
| logD: | 1.2891 |
| logSw: | -3.6367 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.014 |
| InChI Key: | CQRPYYLGCCLURD-UHFFFAOYSA-N |