1-({(2S,4S)-4-fluoro-1-[4-(methoxymethyl)-5-methyl-1,2-oxazole-3-carbonyl]pyrrolidin-2-yl}methyl)-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-({(2S,4S)-4-fluoro-1-[4-(methoxymethyl)-5-methyl-1,2-oxazole-3-carbonyl]pyrrolidin-2-yl}methyl)-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
1-({(2S,4S)-4-fluoro-1-[4-(methoxymethyl)-5-methyl-1,2-oxazole-3-carbonyl]pyrrolidin-2-yl}methyl)-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1116 |
| Compound Name: | 1-({(2S,4S)-4-fluoro-1-[4-(methoxymethyl)-5-methyl-1,2-oxazole-3-carbonyl]pyrrolidin-2-yl}methyl)-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 394.4 |
| Molecular Formula: | C17 H23 F N6 O4 |
| Smiles: | Cc1c(COC)c(C(N2C[C@H](C[C@H]2Cn2cc(C(N(C)C)=O)nn2)F)=O)no1 |
| Stereo: | ABSOLUTE |
| logP: | -0.8405 |
| logD: | -0.8405 |
| logSw: | -0.0754 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 90.002 |
| InChI Key: | UCUCWRZHVVUCLH-NWDGAFQWSA-N |