methyl [4-(2-{4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-1-oxophthalazin-2(1H)-yl}acetamido)phenoxy]acetate
Chemical Structure Depiction of
methyl [4-(2-{4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-1-oxophthalazin-2(1H)-yl}acetamido)phenoxy]acetate
methyl [4-(2-{4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-1-oxophthalazin-2(1H)-yl}acetamido)phenoxy]acetate
Compound characteristics
| Compound ID: | 8012-7687 |
| Compound Name: | methyl [4-(2-{4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-1-oxophthalazin-2(1H)-yl}acetamido)phenoxy]acetate |
| Molecular Weight: | 606.65 |
| Molecular Formula: | C30 H30 N4 O8 S |
| Smiles: | Cc1ccc(cc1S(N1CCOCC1)(=O)=O)C1c2ccccc2C(N(CC(Nc2ccc(cc2)OCC(=O)OC)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5794 |
| logD: | 2.5794 |
| logSw: | -3.1777 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 118.042 |
| InChI Key: | LFJWZGQJWCKALS-UHFFFAOYSA-N |