2-{[5-(5-chloro-2-methoxy-4-nitrophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Chemical Structure Depiction of
2-{[5-(5-chloro-2-methoxy-4-nitrophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
2-{[5-(5-chloro-2-methoxy-4-nitrophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Compound characteristics
| Compound ID: | 8009-0924 |
| Compound Name: | 2-{[5-(5-chloro-2-methoxy-4-nitrophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one |
| Molecular Weight: | 453.86 |
| Molecular Formula: | C21 H12 Cl N3 O5 S |
| Smiles: | COc1cc(c(cc1c1ccc(/C=C2/C(n3c4ccccc4nc3S2)=O)o1)[Cl])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5282 |
| logD: | 5.5282 |
| logSw: | -6.0339 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.733 |
| InChI Key: | YNDVMMZYIYCVKS-UHFFFAOYSA-N |