N-[(3S,5S)-5-(3-methyl-1H-1,2,4-triazol-5-yl)-1-(oxan-4-yl)pyrrolidin-3-yl]benzamide
Chemical Structure Depiction of
N-[(3S,5S)-5-(3-methyl-1H-1,2,4-triazol-5-yl)-1-(oxan-4-yl)pyrrolidin-3-yl]benzamide
N-[(3S,5S)-5-(3-methyl-1H-1,2,4-triazol-5-yl)-1-(oxan-4-yl)pyrrolidin-3-yl]benzamide
Compound characteristics
| Compound ID: | SB18-0375 |
| Compound Name: | N-[(3S,5S)-5-(3-methyl-1H-1,2,4-triazol-5-yl)-1-(oxan-4-yl)pyrrolidin-3-yl]benzamide |
| Molecular Weight: | 355.44 |
| Molecular Formula: | C19 H25 N5 O2 |
| Smiles: | Cc1nc([C@@H]2C[C@@H](CN2C2CCOCC2)NC(c2ccccc2)=O)[nH]n1 |
| Stereo: | ABSOLUTE |
| logP: | 1.4307 |
| logD: | 1.362 |
| logSw: | -1.9315 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.77 |
| InChI Key: | YTPRZEUQHXUDEK-DOTOQJQBSA-N |