N-{rel-(3R,4S)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(pyridin-3-yl)methyl]pyrrolidin-3-yl}cyclopentanecarboxamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(pyridin-3-yl)methyl]pyrrolidin-3-yl}cyclopentanecarboxamide
N-{rel-(3R,4S)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(pyridin-3-yl)methyl]pyrrolidin-3-yl}cyclopentanecarboxamide
Compound characteristics
| Compound ID: | SB33-0116 |
| Compound Name: | N-{rel-(3R,4S)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(pyridin-3-yl)methyl]pyrrolidin-3-yl}cyclopentanecarboxamide |
| Molecular Weight: | 354.45 |
| Molecular Formula: | C19 H26 N6 O |
| Smiles: | Cc1nc([C@@H]2CN(Cc3cccnc3)C[C@H]2NC(C2CCCC2)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.6757 |
| logD: | -0.453 |
| logSw: | -1.7286 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.014 |
| InChI Key: | HBTCHSPPJJKQCT-IRXDYDNUSA-N |