2-{[2,4-bis(morpholin-4-yl)-5-nitrophenyl]methylidene}-6,7-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Chemical Structure Depiction of
2-{[2,4-bis(morpholin-4-yl)-5-nitrophenyl]methylidene}-6,7-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
2-{[2,4-bis(morpholin-4-yl)-5-nitrophenyl]methylidene}-6,7-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Compound characteristics
| Compound ID: | 8008-2719 |
| Compound Name: | 2-{[2,4-bis(morpholin-4-yl)-5-nitrophenyl]methylidene}-6,7-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one |
| Molecular Weight: | 521.59 |
| Molecular Formula: | C26 H27 N5 O5 S |
| Smiles: | Cc1cc2c(cc1C)n1C(/C(=C\c3cc(c(cc3N3CCOCC3)N3CCOCC3)[N+]([O-])=O)Sc1n2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4878 |
| logD: | 4.4878 |
| logSw: | -4.4926 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.653 |
| InChI Key: | PXFYJGRZJZUHOI-UHFFFAOYSA-N |