N-(2,3-dimethylphenyl)-1-(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)prolinamide
Chemical Structure Depiction of
N-(2,3-dimethylphenyl)-1-(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)prolinamide
N-(2,3-dimethylphenyl)-1-(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)prolinamide
Compound characteristics
Compound ID: | F822-0440 |
Compound Name: | N-(2,3-dimethylphenyl)-1-(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)prolinamide |
Molecular Weight: | 443.52 |
Molecular Formula: | C22 H25 N3 O5 S |
Smiles: | CC1C(Nc2cc(ccc2O1)S(N1CCCC1C(Nc1cccc(C)c1C)=O)(=O)=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.9283 |
logD: | 2.928 |
logSw: | -3.325 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 87.788 |
InChI Key: | ANGFUSWJVIJSIV-UHFFFAOYSA-N |