3-(3,4-dimethoxyphenyl)-4-oxo-N-{2-oxo-2-[4-(propan-2-yl)anilino]ethyl}-3,4-dihydrophthalazine-1-carboxamide
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-4-oxo-N-{2-oxo-2-[4-(propan-2-yl)anilino]ethyl}-3,4-dihydrophthalazine-1-carboxamide
3-(3,4-dimethoxyphenyl)-4-oxo-N-{2-oxo-2-[4-(propan-2-yl)anilino]ethyl}-3,4-dihydrophthalazine-1-carboxamide
Compound characteristics
| Compound ID: | C066-0664 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-4-oxo-N-{2-oxo-2-[4-(propan-2-yl)anilino]ethyl}-3,4-dihydrophthalazine-1-carboxamide |
| Molecular Weight: | 500.55 |
| Molecular Formula: | C28 H28 N4 O5 |
| Smiles: | CC(C)c1ccc(cc1)NC(CNC(C1c2ccccc2C(N(c2ccc(c(c2)OC)OC)N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2915 |
| logD: | 4.2914 |
| logSw: | -4.3204 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.871 |
| InChI Key: | WKSLMIYOVYHZJW-UHFFFAOYSA-N |