N-(2-methoxy-5-nitrophenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Chemical Structure Depiction of
N-(2-methoxy-5-nitrophenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
N-(2-methoxy-5-nitrophenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Compound characteristics
| Compound ID: | C066-0340 |
| Compound Name: | N-(2-methoxy-5-nitrophenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide |
| Molecular Weight: | 340.29 |
| Molecular Formula: | C16 H12 N4 O5 |
| Smiles: | COc1ccc(cc1NC(C1c2ccccc2C(NN=1)=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.8903 |
| logD: | 0.7088 |
| logSw: | -2.8155 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.035 |
| InChI Key: | AOMIWZSXHQMQDC-UHFFFAOYSA-N |