2-[5-methyl-2-(propan-2-yl)phenoxy]-N-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)acetamide
Chemical Structure Depiction of
2-[5-methyl-2-(propan-2-yl)phenoxy]-N-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)acetamide
2-[5-methyl-2-(propan-2-yl)phenoxy]-N-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)acetamide
Compound characteristics
Compound ID: | D374-0177 |
Compound Name: | 2-[5-methyl-2-(propan-2-yl)phenoxy]-N-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)acetamide |
Molecular Weight: | 354.4 |
Molecular Formula: | C20 H22 N2 O4 |
Smiles: | [H]N(C(COc1cc(C)ccc1C(C)C)=O)c1ccc2c(c1)NC(CO2)=O |
Stereo: | ACHIRAL |
logP: | 3.707 |
logD: | 3.707 |
logSw: | -3.8738 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 63.972 |
InChI Key: | MRPKKCQFXZAEOU-UHFFFAOYSA-N |