3-(3,4-dimethoxyphenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]-4-oxo-3,4-dihydrophthalazine-1-carboxamide
3-(3,4-dimethoxyphenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Compound characteristics
| Compound ID: | C066-0589 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]-4-oxo-3,4-dihydrophthalazine-1-carboxamide |
| Molecular Weight: | 476.46 |
| Molecular Formula: | C25 H21 F N4 O5 |
| Smiles: | COc1ccc(cc1OC)N1C(c2ccccc2C(C(NCC(Nc2ccc(cc2)F)=O)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9824 |
| logD: | 2.9823 |
| logSw: | -3.7079 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.871 |
| InChI Key: | ULJDXTYVKRQYLP-UHFFFAOYSA-N |