4-(3,3-diethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-(3,3-diethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
4-(3,3-diethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8008-4173 |
| Compound Name: | 4-(3,3-diethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 359.47 |
| Molecular Formula: | C23 H25 N3 O |
| Smiles: | CCC1(CC)Cc2ccccc2/C(=C2\C(C)=NN(C2=O)c2ccccc2)N1 |
| Stereo: | ACHIRAL |
| logP: | 4.6792 |
| logD: | 4.6792 |
| logSw: | -4.4376 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.244 |
| InChI Key: | WIZPVLJQPHOWEJ-UHFFFAOYSA-N |