1-[2-(1,3-benzothiazol-2-yl)hydrazinylidene]-4,4,6-trimethyl-2-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-8-yl 2-chlorobenzoate
Chemical Structure Depiction of
1-[2-(1,3-benzothiazol-2-yl)hydrazinylidene]-4,4,6-trimethyl-2-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-8-yl 2-chlorobenzoate
1-[2-(1,3-benzothiazol-2-yl)hydrazinylidene]-4,4,6-trimethyl-2-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-8-yl 2-chlorobenzoate
Compound characteristics
| Compound ID: | Y020-5900 |
| Compound Name: | 1-[2-(1,3-benzothiazol-2-yl)hydrazinylidene]-4,4,6-trimethyl-2-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-8-yl 2-chlorobenzoate |
| Molecular Weight: | 529.02 |
| Molecular Formula: | C28 H21 Cl N4 O3 S |
| Smiles: | CC1=CC(C)(C)N2C(C(/c3cc(cc1c23)OC(c1ccccc1[Cl])=O)=N/Nc1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.4173 |
| logD: | 7.4173 |
| logSw: | -6.3788 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.535 |
| InChI Key: | ZBGPBFYEBNCVGB-UHFFFAOYSA-N |