2-{[5-(5-chloro-4-methyl-2-nitrophenyl)furan-2-yl]methylidene}-1-benzothiophen-3(2H)-one
Chemical Structure Depiction of
2-{[5-(5-chloro-4-methyl-2-nitrophenyl)furan-2-yl]methylidene}-1-benzothiophen-3(2H)-one
2-{[5-(5-chloro-4-methyl-2-nitrophenyl)furan-2-yl]methylidene}-1-benzothiophen-3(2H)-one
Compound characteristics
| Compound ID: | 8010-2234 |
| Compound Name: | 2-{[5-(5-chloro-4-methyl-2-nitrophenyl)furan-2-yl]methylidene}-1-benzothiophen-3(2H)-one |
| Molecular Weight: | 397.83 |
| Molecular Formula: | C20 H12 Cl N O4 S |
| Smiles: | Cc1cc(c(cc1[Cl])c1ccc(/C=C2/C(c3ccccc3S2)=O)o1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 6.4182 |
| logD: | 6.4182 |
| logSw: | -6.1423 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.05 |
| InChI Key: | RZTZWTUZTLQBOJ-UHFFFAOYSA-N |