6-[5-(2-oxo-2H-1-benzopyran-3-yl)-1,2,4-oxadiazol-3-yl]-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-[5-(2-oxo-2H-1-benzopyran-3-yl)-1,2,4-oxadiazol-3-yl]-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
6-[5-(2-oxo-2H-1-benzopyran-3-yl)-1,2,4-oxadiazol-3-yl]-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | M355-0751 |
| Compound Name: | 6-[5-(2-oxo-2H-1-benzopyran-3-yl)-1,2,4-oxadiazol-3-yl]-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 389.37 |
| Molecular Formula: | C21 H15 N3 O5 |
| Smiles: | CC(C)N1C(=O)Oc2cc(ccc12)c1nc(C2=Cc3ccccc3OC2=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.0738 |
| logD: | 4.0738 |
| logSw: | -4.379 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.387 |
| InChI Key: | VROZRKVJCVOHTQ-UHFFFAOYSA-N |