3-(1,3-benzoxazol-2-yl)-2-oxo-2H-1-benzopyran-7-yl 5-(acetyloxy)-2-methyl-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
3-(1,3-benzoxazol-2-yl)-2-oxo-2H-1-benzopyran-7-yl 5-(acetyloxy)-2-methyl-1-benzofuran-3-carboxylate
3-(1,3-benzoxazol-2-yl)-2-oxo-2H-1-benzopyran-7-yl 5-(acetyloxy)-2-methyl-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 4554-5282 |
| Compound Name: | 3-(1,3-benzoxazol-2-yl)-2-oxo-2H-1-benzopyran-7-yl 5-(acetyloxy)-2-methyl-1-benzofuran-3-carboxylate |
| Molecular Weight: | 495.44 |
| Molecular Formula: | C28 H17 N O8 |
| Smiles: | CC(=O)Oc1ccc2c(c1)c(C(=O)Oc1ccc3C=C(C(=O)Oc3c1)c1nc3ccccc3o1)c(C)o2 |
| Stereo: | ACHIRAL |
| logP: | 4.6774 |
| logD: | 4.6774 |
| logSw: | -4.7879 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 87.047 |
| InChI Key: | CVBNIGBFTBVOLC-UHFFFAOYSA-N |