3-(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
3-(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
3-(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | M338-0244 |
| Compound Name: | 3-(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 454.44 |
| Molecular Formula: | C22 H22 N4 O7 |
| Smiles: | CN1C(COc2cc(ccc12)c1nc(C(NCc2cc(c(c(c2)OC)OC)OC)=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9622 |
| logD: | 1.9622 |
| logSw: | -2.7008 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.174 |
| InChI Key: | IFJIAXOGXCCGNS-UHFFFAOYSA-N |