4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-2H-1,4-benzoxazin-3(4H)-one
4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | L111-0001 |
| Compound Name: | 4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 307.31 |
| Molecular Formula: | C17 H13 N3 O3 |
| Smiles: | C(c1nc(c2ccccc2)no1)N1C(COc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9383 |
| logD: | 2.9383 |
| logSw: | -3.364 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.411 |
| InChI Key: | QRPJCVFZPDPJEN-UHFFFAOYSA-N |