N,N-diethyl-4-[({2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}amino)methyl]aniline--hydrogen chloride (1/1)
Chemical Structure Depiction of
N,N-diethyl-4-[({2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}amino)methyl]aniline--hydrogen chloride (1/1)
N,N-diethyl-4-[({2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}amino)methyl]aniline--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D272-0256 |
| Compound Name: | N,N-diethyl-4-[({2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}amino)methyl]aniline--hydrogen chloride (1/1) |
| Molecular Weight: | 418.99 |
| Molecular Formula: | C20 H26 N6 S |
| Salt: | HCl |
| Smiles: | [H]N(CCSc1nnnn1c1ccccc1)Cc1ccc(cc1)N(CC)CC |
| Stereo: | ACHIRAL |
| logP: | 3.2933 |
| logD: | 0.8137 |
| logSw: | -3.326 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.504 |
| InChI Key: | IOMUSKBAVCOYNX-UHFFFAOYSA-N |