methyl 4-[2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2(1H)-yl)acetamido]benzoate
Chemical Structure Depiction of
methyl 4-[2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2(1H)-yl)acetamido]benzoate
methyl 4-[2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2(1H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | D262-0937 |
| Compound Name: | methyl 4-[2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2(1H)-yl)acetamido]benzoate |
| Molecular Weight: | 417.46 |
| Molecular Formula: | C24 H23 N3 O4 |
| Smiles: | COC(c1ccc(cc1)NC(CN1C(C2CCCCC=2C(c2ccccc2)=N1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2277 |
| logD: | 4.2277 |
| logSw: | -4.2764 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.711 |
| InChI Key: | ZRFFXLBQLRPZDW-UHFFFAOYSA-N |