2-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-6,7-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Chemical Structure Depiction of
2-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-6,7-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
2-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-6,7-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Compound characteristics
| Compound ID: | 8008-7998 |
| Compound Name: | 2-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-6,7-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one |
| Molecular Weight: | 451.89 |
| Molecular Formula: | C22 H14 Cl N3 O4 S |
| Smiles: | Cc1cc2c(cc1C)n1C(/C(=C\c3ccc(c4cc(ccc4[Cl])[N+]([O-])=O)o3)Sc1n2)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3346 |
| logD: | 6.3346 |
| logSw: | -6.3103 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.404 |
| InChI Key: | IVRFEZCMLHYHSO-UHFFFAOYSA-N |