N-[(3S,5S)-1-(2-methylpropyl)-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
Chemical Structure Depiction of
N-[(3S,5S)-1-(2-methylpropyl)-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
N-[(3S,5S)-1-(2-methylpropyl)-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide
Compound characteristics
| Compound ID: | SB18-0987 |
| Compound Name: | N-[(3S,5S)-1-(2-methylpropyl)-5-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]benzamide |
| Molecular Weight: | 327.43 |
| Molecular Formula: | C18 H25 N5 O |
| Smiles: | CC(C)CN1C[C@H](C[C@H]1c1nc(C)n[nH]1)NC(c1ccccc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.1233 |
| logD: | 2.0658 |
| logSw: | -2.5494 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.746 |
| InChI Key: | ZVXKCMSWTGABLU-JKSUJKDBSA-N |