N-(2-{[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]amino}-2-oxoethyl)-3-(2,4-dimethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Chemical Structure Depiction of
N-(2-{[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]amino}-2-oxoethyl)-3-(2,4-dimethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
N-(2-{[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]amino}-2-oxoethyl)-3-(2,4-dimethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Compound characteristics
| Compound ID: | C066-0222 |
| Compound Name: | N-(2-{[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]amino}-2-oxoethyl)-3-(2,4-dimethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide |
| Molecular Weight: | 530.54 |
| Molecular Formula: | C28 H26 N4 O7 |
| Smiles: | COc1ccc(c(c1)OC)N1C(c2ccccc2C(C(NCC(NCC2COc3ccccc3O2)=O)=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9372 |
| logD: | 2.9372 |
| logSw: | -3.6959 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 105.485 |
| InChI Key: | ZMSBEINPUZSDNN-SFHVURJKSA-N |