2-{3-[4-(dimethylamino)phenyl]-1,2,4-oxadiazol-5-yl}-3H-naphtho[2,1-b]pyran-3-one
Chemical Structure Depiction of
2-{3-[4-(dimethylamino)phenyl]-1,2,4-oxadiazol-5-yl}-3H-naphtho[2,1-b]pyran-3-one
2-{3-[4-(dimethylamino)phenyl]-1,2,4-oxadiazol-5-yl}-3H-naphtho[2,1-b]pyran-3-one
Compound characteristics
| Compound ID: | E594-0171 |
| Compound Name: | 2-{3-[4-(dimethylamino)phenyl]-1,2,4-oxadiazol-5-yl}-3H-naphtho[2,1-b]pyran-3-one |
| Molecular Weight: | 383.41 |
| Molecular Formula: | C23 H17 N3 O3 |
| Smiles: | CN(C)c1ccc(cc1)c1nc(C2=Cc3c(ccc4ccccc34)OC2=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 5.0491 |
| logD: | 5.049 |
| logSw: | -5.6736 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.099 |
| InChI Key: | UJRRZYGONRDXFZ-UHFFFAOYSA-N |