1-(4-{5-[({3-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]propyl}amino)methyl]furan-2-yl}phenyl)ethan-1-ol--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-(4-{5-[({3-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]propyl}amino)methyl]furan-2-yl}phenyl)ethan-1-ol--hydrogen chloride (1/1)
1-(4-{5-[({3-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]propyl}amino)methyl]furan-2-yl}phenyl)ethan-1-ol--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D665-0793 |
| Compound Name: | 1-(4-{5-[({3-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]propyl}amino)methyl]furan-2-yl}phenyl)ethan-1-ol--hydrogen chloride (1/1) |
| Molecular Weight: | 409.94 |
| Molecular Formula: | C18 H23 N5 O2 S |
| Salt: | HCl |
| Smiles: | CC(c1ccc(cc1)c1ccc(CNCCCSc2nnnn2C)o1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7241 |
| logD: | 0.6065 |
| logSw: | -2.1156 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.77 |
| InChI Key: | SJKTVMJPZDHVBP-ZDUSSCGKSA-N |