N-[(3S,5S)-1-acetyl-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
Chemical Structure Depiction of
N-[(3S,5S)-1-acetyl-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
N-[(3S,5S)-1-acetyl-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
Compound characteristics
| Compound ID: | SB18-0349 |
| Compound Name: | N-[(3S,5S)-1-acetyl-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide |
| Molecular Weight: | 313.36 |
| Molecular Formula: | C16 H19 N5 O2 |
| Smiles: | CC(N1C[C@H](C[C@H]1c1nc(C)n[nH]1)NC(c1ccccc1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.473 |
| logD: | 0.4723 |
| logSw: | -1.6775 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.964 |
| InChI Key: | GDKROLXNFBBBJV-UONOGXRCSA-N |