6-[5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]-4-propyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-[5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]-4-propyl-2H-1,4-benzoxazin-3(4H)-one
6-[5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]-4-propyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | L834-1173 |
| Compound Name: | 6-[5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]-4-propyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 395.41 |
| Molecular Formula: | C21 H21 N3 O5 |
| Smiles: | CCCN1C(COc2ccc(cc12)c1nc(c2ccc(c(c2)OC)OC)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4745 |
| logD: | 3.4745 |
| logSw: | -3.7247 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.985 |
| InChI Key: | ABIYRLUERJVUBR-UHFFFAOYSA-N |