N-benzyl-1-({(2S,4S)-4-fluoro-1-[(4-methyl-1H-pyrazol-1-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-1-({(2S,4S)-4-fluoro-1-[(4-methyl-1H-pyrazol-1-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
N-benzyl-1-({(2S,4S)-4-fluoro-1-[(4-methyl-1H-pyrazol-1-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-0469 |
| Compound Name: | N-benzyl-1-({(2S,4S)-4-fluoro-1-[(4-methyl-1H-pyrazol-1-yl)acetyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 425.46 |
| Molecular Formula: | C21 H24 F N7 O2 |
| Smiles: | Cc1cnn(CC(N2C[C@H](C[C@H]2Cn2cc(C(NCc3ccccc3)=O)nn2)F)=O)c1 |
| Stereo: | ABSOLUTE |
| logP: | 0.7968 |
| logD: | 0.7968 |
| logSw: | -1.6522 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.009 |
| InChI Key: | SDHNRXRKJVBLIN-ZWKOTPCHSA-N |