(2S)-N-benzyl-2-(5-phenyl-4H-1,2,4-triazol-3-yl)pyrrolidine-1-carboxamide
Chemical Structure Depiction of
(2S)-N-benzyl-2-(5-phenyl-4H-1,2,4-triazol-3-yl)pyrrolidine-1-carboxamide
(2S)-N-benzyl-2-(5-phenyl-4H-1,2,4-triazol-3-yl)pyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | P930-1357 |
| Compound Name: | (2S)-N-benzyl-2-(5-phenyl-4H-1,2,4-triazol-3-yl)pyrrolidine-1-carboxamide |
| Molecular Weight: | 347.42 |
| Molecular Formula: | C20 H21 N5 O |
| Smiles: | C1C[C@@H](c2nnc(c3ccccc3)[nH]2)N(C1)C(NCc1ccccc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.5419 |
| logD: | 2.5063 |
| logSw: | -2.7005 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.603 |
| InChI Key: | BSEFUBBKJRLMQH-KRWDZBQOSA-N |