2-methyl-6-{[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}-1H-benzo[de]isoquinoline-1,3(2H)-dione
Chemical Structure Depiction of
2-methyl-6-{[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}-1H-benzo[de]isoquinoline-1,3(2H)-dione
2-methyl-6-{[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}-1H-benzo[de]isoquinoline-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8004-6187 |
| Compound Name: | 2-methyl-6-{[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}-1H-benzo[de]isoquinoline-1,3(2H)-dione |
| Molecular Weight: | 410.43 |
| Molecular Formula: | C24 H18 N4 O3 |
| Smiles: | CC1/C(=C/Nc2ccc3C(N(C)C(c4cccc2c34)=O)=O)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9896 |
| logD: | 2.9698 |
| logSw: | -3.7991 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.143 |
| InChI Key: | FPVUIAXJNODNCQ-UHFFFAOYSA-N |