2-{[(3-bromophenyl)methanesulfonyl]methyl}-N-[(4-chlorophenyl)methyl]-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Chemical Structure Depiction of
2-{[(3-bromophenyl)methanesulfonyl]methyl}-N-[(4-chlorophenyl)methyl]-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
2-{[(3-bromophenyl)methanesulfonyl]methyl}-N-[(4-chlorophenyl)methyl]-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Compound characteristics
Compound ID: | K977-0533 |
Compound Name: | 2-{[(3-bromophenyl)methanesulfonyl]methyl}-N-[(4-chlorophenyl)methyl]-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide |
Molecular Weight: | 562.87 |
Molecular Formula: | C24 H21 Br Cl N3 O4 S |
Smiles: | C(c1ccc(cc1)[Cl])NC(c1ccc2c(c1)NC(C(CS(Cc1cccc(c1)[Br])(=O)=O)N2)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.8884 |
logD: | 3.888 |
logSw: | -4.4165 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 89.811 |
InChI Key: | ZIUASSDWDUHECV-QFIPXVFZSA-N |