(1-{[(2S,4S)-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
(1-{[(2S,4S)-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone
(1-{[(2S,4S)-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | SB21-0232 |
| Compound Name: | (1-{[(2S,4S)-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 390.42 |
| Molecular Formula: | C18 H23 F N6 O3 |
| Smiles: | Cc1c(C(N2C[C@H](C[C@H]2Cn2cc(C(N3CCCC3)=O)nn2)F)=O)c(C)on1 |
| Stereo: | ABSOLUTE |
| logP: | 0.4287 |
| logD: | 0.4287 |
| logSw: | -0.65 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 82.398 |
| InChI Key: | ATWFCMDTDYQUAA-UONOGXRCSA-N |