N,N-diethyl-4-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Chemical Structure Depiction of
N,N-diethyl-4-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
N,N-diethyl-4-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Compound characteristics
| Compound ID: | F118-0681 |
| Compound Name: | N,N-diethyl-4-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide |
| Molecular Weight: | 413.45 |
| Molecular Formula: | C22 H24 F N3 O4 |
| Smiles: | CCN(CC)C(c1ccc2c(c1)N(CC(NCc1ccc(cc1)F)=O)C(CO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3406 |
| logD: | 1.3406 |
| logSw: | -2.35 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.472 |
| InChI Key: | HTQJEIGFGOPOHR-UHFFFAOYSA-N |