6-[5-(3-methylthiophen-2-yl)-1,2,4-oxadiazol-3-yl]-4-propyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-[5-(3-methylthiophen-2-yl)-1,2,4-oxadiazol-3-yl]-4-propyl-2H-1,4-benzoxazin-3(4H)-one
6-[5-(3-methylthiophen-2-yl)-1,2,4-oxadiazol-3-yl]-4-propyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | L834-1064 |
| Compound Name: | 6-[5-(3-methylthiophen-2-yl)-1,2,4-oxadiazol-3-yl]-4-propyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 355.41 |
| Molecular Formula: | C18 H17 N3 O3 S |
| Smiles: | CCCN1C(COc2ccc(cc12)c1nc(c2c(C)ccs2)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0582 |
| logD: | 4.0582 |
| logSw: | -4.1023 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.742 |
| InChI Key: | IJTXAPIUOGEBQE-UHFFFAOYSA-N |