N-[(3-methoxyphenyl)methyl]-3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propan-1-amine
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propan-1-amine
N-[(3-methoxyphenyl)methyl]-3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propan-1-amine
Compound characteristics
| Compound ID: | D272-0408 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propan-1-amine |
| Molecular Weight: | 391.92 |
| Molecular Formula: | C18 H21 N5 O S |
| Salt: | HCl |
| Smiles: | [H]N(CCCSc1nnnn1c1ccccc1)Cc1cccc(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.7727 |
| logD: | -0.8657 |
| logSw: | -3.1869 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.312 |
| InChI Key: | MBZUKMRUOMLTAV-UHFFFAOYSA-N |