2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-3H-naphtho[2,1-b]pyran-3-one
Chemical Structure Depiction of
2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-3H-naphtho[2,1-b]pyran-3-one
2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-3H-naphtho[2,1-b]pyran-3-one
Compound characteristics
| Compound ID: | E594-0177 |
| Compound Name: | 2-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-3H-naphtho[2,1-b]pyran-3-one |
| Molecular Weight: | 430.42 |
| Molecular Formula: | C24 H18 N2 O6 |
| Smiles: | COc1cc(cc(c1OC)OC)c1nc(C2=Cc3c(ccc4ccccc34)OC2=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.4414 |
| logD: | 4.4414 |
| logSw: | -4.7225 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.272 |
| InChI Key: | UTMWOFHEXIQKOG-UHFFFAOYSA-N |