methyl 4-{2-[4-(morpholin-4-yl)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 4-{2-[4-(morpholin-4-yl)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate
methyl 4-{2-[4-(morpholin-4-yl)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate
Compound characteristics
Compound ID: | M183-0446 |
Compound Name: | methyl 4-{2-[4-(morpholin-4-yl)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate |
Molecular Weight: | 422.44 |
Molecular Formula: | C22 H22 N4 O5 |
Smiles: | COC(c1ccc(cc1)NC(CN1C(c2ccccc2C(=N1)N1CCOCC1)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.0448 |
logD: | 2.0448 |
logSw: | -2.9574 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 82.469 |
InChI Key: | GDJSXUYCGIATEK-UHFFFAOYSA-N |