1-({(2S,4S)-4-fluoro-1-[3-(4-methoxyphenyl)propanoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-({(2S,4S)-4-fluoro-1-[3-(4-methoxyphenyl)propanoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
1-({(2S,4S)-4-fluoro-1-[3-(4-methoxyphenyl)propanoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1265 |
| Compound Name: | 1-({(2S,4S)-4-fluoro-1-[3-(4-methoxyphenyl)propanoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 375.4 |
| Molecular Formula: | C18 H22 F N5 O3 |
| Smiles: | COc1ccc(CCC(N2C[C@H](C[C@H]2Cn2cc(C(N)=O)nn2)F)=O)cc1 |
| Stereo: | ABSOLUTE |
| logP: | 0.9294 |
| logD: | 0.9294 |
| logSw: | -1.6058 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.421 |
| InChI Key: | HCDYEUGDUBILJO-UONOGXRCSA-N |