5-(1-benzylpyrrolidin-2-yl)-4-(4-chlorophenyl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-(1-benzylpyrrolidin-2-yl)-4-(4-chlorophenyl)-4H-1,2,4-triazole-3-thiol
5-(1-benzylpyrrolidin-2-yl)-4-(4-chlorophenyl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8016-0412 |
| Compound Name: | 5-(1-benzylpyrrolidin-2-yl)-4-(4-chlorophenyl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 370.9 |
| Molecular Formula: | C19 H19 Cl N4 S |
| Smiles: | [H][C@]1(CCCN1Cc1ccccc1)c1nnc(n1c1ccc(cc1)[Cl])S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7386 |
| logD: | 2.4793 |
| logSw: | -4.2427 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.4159 |
| InChI Key: | NUBGPENOHGDBHU-KRWDZBQOSA-N |