8-methoxy-4,4-dimethyl-6-({[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
Chemical Structure Depiction of
8-methoxy-4,4-dimethyl-6-({[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
8-methoxy-4,4-dimethyl-6-({[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
Compound characteristics
| Compound ID: | Y021-2401 |
| Compound Name: | 8-methoxy-4,4-dimethyl-6-({[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C24 H21 N3 O4 S |
| Smiles: | Cc1ccc(cc1)c1nnc(o1)SCC1=CC(C)(C)N2C(C(c3cc(cc1c23)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4514 |
| logD: | 4.4514 |
| logSw: | -4.4117 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.209 |
| InChI Key: | BFWZORYSYMEBGQ-UHFFFAOYSA-N |