N-{5-[4-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperazine-1-carbonyl]-2-methylphenyl}acetamide
Chemical Structure Depiction of
N-{5-[4-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperazine-1-carbonyl]-2-methylphenyl}acetamide
N-{5-[4-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperazine-1-carbonyl]-2-methylphenyl}acetamide
Compound characteristics
Compound ID: | F537-0301 |
Compound Name: | N-{5-[4-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperazine-1-carbonyl]-2-methylphenyl}acetamide |
Molecular Weight: | 500.57 |
Molecular Formula: | C24 H28 N4 O6 S |
Smiles: | CCC1C(Nc2cc(ccc2O1)S(N1CCN(CC1)C(c1ccc(C)c(c1)NC(C)=O)=O)(=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.2215 |
logD: | 1.2211 |
logSw: | -2.4791 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 103.773 |
InChI Key: | MRHGXSDYJKBKKO-OAQYLSRUSA-N |