2-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1-benzothiophen-3(2H)-one
Chemical Structure Depiction of
2-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1-benzothiophen-3(2H)-one
2-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1-benzothiophen-3(2H)-one
Compound characteristics
| Compound ID: | 8007-4010 |
| Compound Name: | 2-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1-benzothiophen-3(2H)-one |
| Molecular Weight: | 363.39 |
| Molecular Formula: | C20 H13 N O4 S |
| Smiles: | Cc1ccc(cc1c1ccc(\C=C2/C(c3ccccc3S2)=O)o1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4594 |
| logD: | 5.4594 |
| logSw: | -5.4935 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.351 |
| InChI Key: | ABAMPLTYAXDEBF-UHFFFAOYSA-N |