methyl 2-{2-[4-(morpholin-4-yl)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 2-{2-[4-(morpholin-4-yl)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate
methyl 2-{2-[4-(morpholin-4-yl)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | M183-0454 |
| Compound Name: | methyl 2-{2-[4-(morpholin-4-yl)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate |
| Molecular Weight: | 422.44 |
| Molecular Formula: | C22 H22 N4 O5 |
| Smiles: | COC(c1ccccc1NC(CN1C(c2ccccc2C(=N1)N1CCOCC1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6787 |
| logD: | 1.6723 |
| logSw: | -2.6145 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.771 |
| InChI Key: | UJYSPAIMNBRNTP-UHFFFAOYSA-N |