6,7-dimethyl-2-{[5-nitro-2,4-di(piperidin-1-yl)phenyl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Chemical Structure Depiction of
6,7-dimethyl-2-{[5-nitro-2,4-di(piperidin-1-yl)phenyl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
6,7-dimethyl-2-{[5-nitro-2,4-di(piperidin-1-yl)phenyl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Compound characteristics
| Compound ID: | 2038-0176 |
| Compound Name: | 6,7-dimethyl-2-{[5-nitro-2,4-di(piperidin-1-yl)phenyl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one |
| Molecular Weight: | 517.65 |
| Molecular Formula: | C28 H31 N5 O3 S |
| Smiles: | Cc1cc2c(cc1C)n1C(/C(=C\c3cc(c(cc3N3CCCCC3)N3CCCCC3)[N+]([O-])=O)Sc1n2)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8051 |
| logD: | 6.8051 |
| logSw: | -5.5575 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.836 |
| InChI Key: | FQQBSTJWPDAGNH-UHFFFAOYSA-N |