3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3-ethylphenyl)propanamide
Chemical Structure Depiction of
3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3-ethylphenyl)propanamide
3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3-ethylphenyl)propanamide
Compound characteristics
Compound ID: | E511-0631 |
Compound Name: | 3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3-ethylphenyl)propanamide |
Molecular Weight: | 422.89 |
Molecular Formula: | C19 H19 Cl N2 O5 S |
Smiles: | CCc1cccc(c1)NC(CCS(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.6191 |
logD: | 2.5976 |
logSw: | -3.2653 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 85.423 |
InChI Key: | HPZVSLJUSQPJCG-UHFFFAOYSA-N |