3-[3-(1',5'-dimethyl-1-phenyl-1H,1'H-[3,4'-bipyrazol]-4-yl)prop-2-enoyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[3-(1',5'-dimethyl-1-phenyl-1H,1'H-[3,4'-bipyrazol]-4-yl)prop-2-enoyl]-2H-1-benzopyran-2-one
3-[3-(1',5'-dimethyl-1-phenyl-1H,1'H-[3,4'-bipyrazol]-4-yl)prop-2-enoyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y505-7205 |
| Compound Name: | 3-[3-(1',5'-dimethyl-1-phenyl-1H,1'H-[3,4'-bipyrazol]-4-yl)prop-2-enoyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 436.47 |
| Molecular Formula: | C26 H20 N4 O3 |
| Smiles: | Cc1c(cnn1C)c1c(/C=C/C(C2=Cc3ccccc3OC2=O)=O)cn(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.7137 |
| logD: | 3.7137 |
| logSw: | -4.1846 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 63.255 |
| InChI Key: | VZHCDFGEWPOOQM-UHFFFAOYSA-N |