3-({[5-(4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-({[5-(4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetyl)-2H-1-benzopyran-2-one
3-({[5-(4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 7653-2984 |
| Compound Name: | 3-({[5-(4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 380.38 |
| Molecular Formula: | C19 H12 N2 O5 S |
| Smiles: | C(C(C1=Cc2ccccc2OC1=O)=O)Sc1nnc(c2ccc(cc2)O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.4712 |
| logD: | 2.4627 |
| logSw: | -2.731 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.85 |
| InChI Key: | YRELAQVGSLUSLO-UHFFFAOYSA-N |