propan-2-yl 4-[2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetamido]benzoate
Chemical Structure Depiction of
propan-2-yl 4-[2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetamido]benzoate
propan-2-yl 4-[2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | Y043-3054 |
| Compound Name: | propan-2-yl 4-[2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetamido]benzoate |
| Molecular Weight: | 379.41 |
| Molecular Formula: | C21 H21 N3 O4 |
| Smiles: | CC(C)OC(c1ccc(cc1)NC(CC1c2ccccc2C(N(C)N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7362 |
| logD: | 2.7361 |
| logSw: | -3.5321 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.632 |
| InChI Key: | HWSMRDFMTIRQJX-UHFFFAOYSA-N |