N-butyl-2-{[(4-fluorophenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Chemical Structure Depiction of
N-butyl-2-{[(4-fluorophenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
N-butyl-2-{[(4-fluorophenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Compound characteristics
| Compound ID: | K977-0276 |
| Compound Name: | N-butyl-2-{[(4-fluorophenyl)methanesulfonyl]methyl}-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide |
| Molecular Weight: | 433.5 |
| Molecular Formula: | C21 H24 F N3 O4 S |
| Smiles: | CCCCNC(c1ccc2c(c1)NC(C(CS(Cc1ccc(cc1)F)(=O)=O)N2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1467 |
| logD: | 2.1463 |
| logSw: | -2.8806 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.924 |
| InChI Key: | HNISPXUUJJHFHO-IBGZPJMESA-N |