3-chloro-N-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-4-methoxybenzamide
Chemical Structure Depiction of
3-chloro-N-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-4-methoxybenzamide
3-chloro-N-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-4-methoxybenzamide
Compound characteristics
Compound ID: | D519-0398 |
Compound Name: | 3-chloro-N-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-4-methoxybenzamide |
Molecular Weight: | 360.8 |
Molecular Formula: | C18 H17 Cl N2 O4 |
Smiles: | [H]N(C(c1ccc(c(c1)[Cl])OC)=O)c1ccc2c(c1)N(CC)C(CO2)=O |
Stereo: | ACHIRAL |
logP: | 2.71 |
logD: | 2.6931 |
logSw: | -3.6333 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.786 |
InChI Key: | XLXHULSMKUGCPY-UHFFFAOYSA-N |