8-methoxy-6-({[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-4,4-dimethyl-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
Chemical Structure Depiction of
8-methoxy-6-({[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-4,4-dimethyl-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
8-methoxy-6-({[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-4,4-dimethyl-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
Compound characteristics
| Compound ID: | Y021-2771 |
| Compound Name: | 8-methoxy-6-({[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-4,4-dimethyl-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione |
| Molecular Weight: | 463.51 |
| Molecular Formula: | C24 H21 N3 O5 S |
| Smiles: | CC1(C)C=C(CSc2nnc(c3ccc(cc3)OC)o2)c2cc(cc3C(C(N1c23)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.0104 |
| logD: | 4.0104 |
| logSw: | -4.3467 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.753 |
| InChI Key: | HKTSYTLHMSGPAS-UHFFFAOYSA-N |