1-[(2S,4S)-2-{[4-(2,3-dihydro-1H-indole-1-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}-4-fluoropyrrolidin-1-yl]-2-(4-methyl-1H-pyrazol-1-yl)ethan-1-one
Chemical Structure Depiction of
1-[(2S,4S)-2-{[4-(2,3-dihydro-1H-indole-1-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}-4-fluoropyrrolidin-1-yl]-2-(4-methyl-1H-pyrazol-1-yl)ethan-1-one
1-[(2S,4S)-2-{[4-(2,3-dihydro-1H-indole-1-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}-4-fluoropyrrolidin-1-yl]-2-(4-methyl-1H-pyrazol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | SB21-1428 |
| Compound Name: | 1-[(2S,4S)-2-{[4-(2,3-dihydro-1H-indole-1-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}-4-fluoropyrrolidin-1-yl]-2-(4-methyl-1H-pyrazol-1-yl)ethan-1-one |
| Molecular Weight: | 437.48 |
| Molecular Formula: | C22 H24 F N7 O2 |
| Smiles: | Cc1cnn(CC(N2C[C@H](C[C@H]2Cn2cc(C(N3CCc4ccccc34)=O)nn2)F)=O)c1 |
| Stereo: | ABSOLUTE |
| logP: | 1.1178 |
| logD: | 1.1178 |
| logSw: | -1.7983 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 73.274 |
| InChI Key: | YATFAQOQPQRAQI-ZWKOTPCHSA-N |