4-acetyl-N-[2-(3,4-diethoxyphenyl)ethyl]-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
Chemical Structure Depiction of
4-acetyl-N-[2-(3,4-diethoxyphenyl)ethyl]-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
4-acetyl-N-[2-(3,4-diethoxyphenyl)ethyl]-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
Compound characteristics
Compound ID: | E204-0222 |
Compound Name: | 4-acetyl-N-[2-(3,4-diethoxyphenyl)ethyl]-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide |
Molecular Weight: | 448.54 |
Molecular Formula: | C22 H28 N2 O6 S |
Smiles: | CCOc1ccc(CCNS(c2ccc3c(c2)N(CCO3)C(C)=O)(=O)=O)cc1OCC |
Stereo: | ACHIRAL |
logP: | 2.3932 |
logD: | 2.3932 |
logSw: | -2.8935 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 80.262 |
InChI Key: | SURVITHWGBNELR-UHFFFAOYSA-N |