methyl 3-[4-(4-chlorophenyl)-1-oxophthalazin-2(1H)-yl]propanoate
Chemical Structure Depiction of
methyl 3-[4-(4-chlorophenyl)-1-oxophthalazin-2(1H)-yl]propanoate
methyl 3-[4-(4-chlorophenyl)-1-oxophthalazin-2(1H)-yl]propanoate
Compound characteristics
| Compound ID: | 6016-3233 |
| Compound Name: | methyl 3-[4-(4-chlorophenyl)-1-oxophthalazin-2(1H)-yl]propanoate |
| Molecular Weight: | 342.78 |
| Molecular Formula: | C18 H15 Cl N2 O3 |
| Smiles: | COC(CCN1C(c2ccccc2C(c2ccc(cc2)[Cl])=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9381 |
| logD: | 2.938 |
| logSw: | -3.6842 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.024 |
| InChI Key: | LEUYXBWPKGKHSA-UHFFFAOYSA-N |