[(2S)-4,4-difluoro-2-{[(pyridin-4-yl)oxy]methyl}pyrrolidin-1-yl](3',5'-dimethyl-1'-propyl-1H,1'H-[3,4'-bipyrazol]-5-yl)methanone
Chemical Structure Depiction of
[(2S)-4,4-difluoro-2-{[(pyridin-4-yl)oxy]methyl}pyrrolidin-1-yl](3',5'-dimethyl-1'-propyl-1H,1'H-[3,4'-bipyrazol]-5-yl)methanone
[(2S)-4,4-difluoro-2-{[(pyridin-4-yl)oxy]methyl}pyrrolidin-1-yl](3',5'-dimethyl-1'-propyl-1H,1'H-[3,4'-bipyrazol]-5-yl)methanone
Compound characteristics
Compound ID: | CM4579-5021 |
Compound Name: | [(2S)-4,4-difluoro-2-{[(pyridin-4-yl)oxy]methyl}pyrrolidin-1-yl](3',5'-dimethyl-1'-propyl-1H,1'H-[3,4'-bipyrazol]-5-yl)methanone |
Molecular Weight: | 444.48 |
Molecular Formula: | C22 H26 F2 N6 O2 |
Smiles: | CCCn1c(C)c(c2cc(C(N3CC(C[C@H]3COc3ccncc3)(F)F)=O)[nH]n2)c(C)n1 |
Stereo: | ABSOLUTE |
logP: | 2.2074 |
logD: | 2.2066 |
logSw: | -2.5623 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.51 |
InChI Key: | FWCDDLAFCPWUOO-INIZCTEOSA-N |