N,N-dimethyl-4-[({2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}amino)methyl]aniline--hydrogen chloride (1/1)
Chemical Structure Depiction of
N,N-dimethyl-4-[({2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}amino)methyl]aniline--hydrogen chloride (1/1)
N,N-dimethyl-4-[({2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}amino)methyl]aniline--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D660-0169 |
| Compound Name: | N,N-dimethyl-4-[({2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethyl}amino)methyl]aniline--hydrogen chloride (1/1) |
| Molecular Weight: | 328.86 |
| Molecular Formula: | C13 H20 N6 S |
| Salt: | HCl |
| Smiles: | [H]N(CCSc1nnnn1C)Cc1ccc(cc1)N(C)C |
| Stereo: | ACHIRAL |
| logP: | 0.9532 |
| logD: | -2.0865 |
| logSw: | -1.5076 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.994 |
| InChI Key: | BJCSOZSFDBPJCS-UHFFFAOYSA-N |