2-({3-[(4-nitrophenyl)methoxy]phenyl}methylidene)-1-benzothiophen-3(2H)-one
Chemical Structure Depiction of
2-({3-[(4-nitrophenyl)methoxy]phenyl}methylidene)-1-benzothiophen-3(2H)-one
2-({3-[(4-nitrophenyl)methoxy]phenyl}methylidene)-1-benzothiophen-3(2H)-one
Compound characteristics
| Compound ID: | 1690-0107 |
| Compound Name: | 2-({3-[(4-nitrophenyl)methoxy]phenyl}methylidene)-1-benzothiophen-3(2H)-one |
| Molecular Weight: | 389.43 |
| Molecular Formula: | C22 H15 N O4 S |
| Smiles: | C(c1ccc(cc1)[N+]([O-])=O)Oc1cccc(/C=C2/C(c3ccccc3S2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.2248 |
| logD: | 5.2248 |
| logSw: | -5.513 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.009 |
| InChI Key: | YDHLFBGXDIWFJT-UHFFFAOYSA-N |