3-[benzyl(2-phenylethyl)amino]-4-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-[benzyl(2-phenylethyl)amino]-4-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)cyclobut-3-ene-1,2-dione
3-[benzyl(2-phenylethyl)amino]-4-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E786-0986 |
| Compound Name: | 3-[benzyl(2-phenylethyl)amino]-4-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 438.48 |
| Molecular Formula: | C27 H22 N2 O4 |
| Smiles: | C(CN(Cc1ccccc1)C1=C(C(C1=O)=O)c1ccc2c(c1)OCC(N2)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0693 |
| logD: | 4.0693 |
| logSw: | -4.308 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.693 |
| InChI Key: | AVTSQBQGORTZPP-UHFFFAOYSA-N |