ethyl 4-{2,5-dimethyl-3-[(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]-1H-pyrrol-1-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{2,5-dimethyl-3-[(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]-1H-pyrrol-1-yl}benzoate
ethyl 4-{2,5-dimethyl-3-[(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]-1H-pyrrol-1-yl}benzoate
Compound characteristics
| Compound ID: | 3958-4587 |
| Compound Name: | ethyl 4-{2,5-dimethyl-3-[(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]-1H-pyrrol-1-yl}benzoate |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C25 H21 N3 O3 S |
| Smiles: | CCOC(c1ccc(cc1)n1c(C)cc(/C=C2/C(n3c4ccccc4nc3S2)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0954 |
| logD: | 5.0954 |
| logSw: | -4.9424 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.871 |
| InChI Key: | KZXWUELOUYCKOH-UHFFFAOYSA-N |