3-phenyl-5-[(pyrrolidin-3-yl)methyl]-4H-1,2,4-triazole--hydrogen chloride (1/2)
Chemical Structure Depiction of
3-phenyl-5-[(pyrrolidin-3-yl)methyl]-4H-1,2,4-triazole--hydrogen chloride (1/2)
3-phenyl-5-[(pyrrolidin-3-yl)methyl]-4H-1,2,4-triazole--hydrogen chloride (1/2)
Compound characteristics
| Compound ID: | P937-1867 |
| Compound Name: | 3-phenyl-5-[(pyrrolidin-3-yl)methyl]-4H-1,2,4-triazole--hydrogen chloride (1/2) |
| Molecular Weight: | 301.22 |
| Molecular Formula: | C13 H16 N4 |
| Salt: | 2HCl |
| Smiles: | [H]N1CCC(Cc2nnc(c3ccccc3)[nH]2)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6637 |
| logD: | -2.4992 |
| logSw: | -1.4993 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.192 |
| InChI Key: | BUALELCNKQLAHU-SNVBAGLBSA-N |