[(2S)-4,4-difluoro-2-{[4-(morpholine-4-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}pyrrolidin-1-yl](1-ethyl-1H-pyrazol-5-yl)methanone
Chemical Structure Depiction of
[(2S)-4,4-difluoro-2-{[4-(morpholine-4-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}pyrrolidin-1-yl](1-ethyl-1H-pyrazol-5-yl)methanone
[(2S)-4,4-difluoro-2-{[4-(morpholine-4-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}pyrrolidin-1-yl](1-ethyl-1H-pyrazol-5-yl)methanone
Compound characteristics
| Compound ID: | SB36-0653 |
| Compound Name: | [(2S)-4,4-difluoro-2-{[4-(morpholine-4-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}pyrrolidin-1-yl](1-ethyl-1H-pyrazol-5-yl)methanone |
| Molecular Weight: | 423.42 |
| Molecular Formula: | C18 H23 F2 N7 O3 |
| Smiles: | CCn1c(ccn1)C(N1CC(C[C@H]1Cn1cc(C(N2CCOCC2)=O)nn1)(F)F)=O |
| Stereo: | ABSOLUTE |
| logP: | -0.3018 |
| logD: | -0.3018 |
| logSw: | -1.1618 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 80.991 |
| InChI Key: | VNOLVOUEIXXADX-CYBMUJFWSA-N |