1-({(2S,4S)-1-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]-4-fluoropyrrolidin-2-yl}methyl)-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-({(2S,4S)-1-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]-4-fluoropyrrolidin-2-yl}methyl)-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
1-({(2S,4S)-1-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]-4-fluoropyrrolidin-2-yl}methyl)-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-0011 |
| Compound Name: | 1-({(2S,4S)-1-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]-4-fluoropyrrolidin-2-yl}methyl)-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 392.43 |
| Molecular Formula: | C18 H25 F N6 O3 |
| Smiles: | Cc1c(CCC(N2C[C@H](C[C@H]2Cn2cc(C(N(C)C)=O)nn2)F)=O)c(C)on1 |
| Stereo: | ABSOLUTE |
| logP: | -0.2784 |
| logD: | -0.2784 |
| logSw: | -0.0427 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 80.857 |
| InChI Key: | RQEPKERDVDQHKD-UONOGXRCSA-N |