ethyl 4-(3-benzyl-4-methyl-2-oxo-2H,8H-pyrano[2,3-f][1,3]benzoxazin-9(10H)-yl)benzoate
Chemical Structure Depiction of
ethyl 4-(3-benzyl-4-methyl-2-oxo-2H,8H-pyrano[2,3-f][1,3]benzoxazin-9(10H)-yl)benzoate
ethyl 4-(3-benzyl-4-methyl-2-oxo-2H,8H-pyrano[2,3-f][1,3]benzoxazin-9(10H)-yl)benzoate
Compound characteristics
| Compound ID: | E754-0262 |
| Compound Name: | ethyl 4-(3-benzyl-4-methyl-2-oxo-2H,8H-pyrano[2,3-f][1,3]benzoxazin-9(10H)-yl)benzoate |
| Molecular Weight: | 455.51 |
| Molecular Formula: | C28 H25 N O5 |
| Smiles: | CCOC(c1ccc(cc1)N1Cc2c(ccc3C(C)=C(Cc4ccccc4)C(=O)Oc23)OC1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3713 |
| logD: | 6.3713 |
| logSw: | -5.671 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.631 |
| InChI Key: | QIAINXDRDNEHTK-UHFFFAOYSA-N |