N-(3-chloro-4-methoxyphenyl)-2-[3-oxo-6-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-[3-oxo-6-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
N-(3-chloro-4-methoxyphenyl)-2-[3-oxo-6-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
Compound characteristics
Compound ID: | F118-0117 |
Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-[3-oxo-6-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide |
Molecular Weight: | 443.89 |
Molecular Formula: | C22 H22 Cl N3 O5 |
Smiles: | COc1ccc(cc1[Cl])NC(CN1C(COc2ccc(cc12)C(N1CCCC1)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.3065 |
logD: | 2.3059 |
logSw: | -3.382 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.862 |
InChI Key: | MXTSQVQXCYQDHF-UHFFFAOYSA-N |