4-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-{2-[5-(pyridin-3-yl)-1,2,4-oxadiazol-3-yl]ethyl}butanamide
Chemical Structure Depiction of
4-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-{2-[5-(pyridin-3-yl)-1,2,4-oxadiazol-3-yl]ethyl}butanamide
4-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-{2-[5-(pyridin-3-yl)-1,2,4-oxadiazol-3-yl]ethyl}butanamide
Compound characteristics
| Compound ID: | S399-1723 |
| Compound Name: | 4-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-{2-[5-(pyridin-3-yl)-1,2,4-oxadiazol-3-yl]ethyl}butanamide |
| Molecular Weight: | 421.45 |
| Molecular Formula: | C22 H23 N5 O4 |
| Smiles: | Cc1ccc2c(c1)N(CCCC(NCCc1nc(c3cccnc3)on1)=O)C(CO2)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5652 |
| logD: | 0.4719 |
| logSw: | -1.2122 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.545 |
| InChI Key: | JFJVXSDMPBTQKJ-UHFFFAOYSA-N |