2-methyl-4-[(3-{4-[(propan-2-yl)oxy]phenyl}-1,2,4-oxadiazol-5-yl)methyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
2-methyl-4-[(3-{4-[(propan-2-yl)oxy]phenyl}-1,2,4-oxadiazol-5-yl)methyl]-2H-1,4-benzoxazin-3(4H)-one
2-methyl-4-[(3-{4-[(propan-2-yl)oxy]phenyl}-1,2,4-oxadiazol-5-yl)methyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | L111-0392 |
| Compound Name: | 2-methyl-4-[(3-{4-[(propan-2-yl)oxy]phenyl}-1,2,4-oxadiazol-5-yl)methyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 379.41 |
| Molecular Formula: | C21 H21 N3 O4 |
| Smiles: | CC(C)Oc1ccc(cc1)c1nc(CN2C(C(C)Oc3ccccc23)=O)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2173 |
| logD: | 4.2173 |
| logSw: | -4.3659 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.218 |
| InChI Key: | MICUDEGXUZXZES-AWEZNQCLSA-N |