6,8-dimethyl-2-{[5-(2-nitrophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Chemical Structure Depiction of
6,8-dimethyl-2-{[5-(2-nitrophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
6,8-dimethyl-2-{[5-(2-nitrophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Compound characteristics
| Compound ID: | 2367-1175 |
| Compound Name: | 6,8-dimethyl-2-{[5-(2-nitrophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one |
| Molecular Weight: | 417.44 |
| Molecular Formula: | C22 H15 N3 O4 S |
| Smiles: | Cc1cc(C)c2c(c1)n1C(/C(=C/c3ccc(c4ccccc4[N+]([O-])=O)o3)Sc1n2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2603 |
| logD: | 5.2603 |
| logSw: | -5.1415 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.873 |
| InChI Key: | OICPUFFVXMGTIC-UHFFFAOYSA-N |