2-methoxy-7,7-dimethyl-9-[4-(pentyloxy)phenyl]-10-sulfanylidene-9,10-dihydro-7H-pyrrolo[3,2,1-ij][1,2]thiazolo[5,4-c]quinoline-4,5-dione
Chemical Structure Depiction of
2-methoxy-7,7-dimethyl-9-[4-(pentyloxy)phenyl]-10-sulfanylidene-9,10-dihydro-7H-pyrrolo[3,2,1-ij][1,2]thiazolo[5,4-c]quinoline-4,5-dione
2-methoxy-7,7-dimethyl-9-[4-(pentyloxy)phenyl]-10-sulfanylidene-9,10-dihydro-7H-pyrrolo[3,2,1-ij][1,2]thiazolo[5,4-c]quinoline-4,5-dione
Compound characteristics
| Compound ID: | Y020-0545 |
| Compound Name: | 2-methoxy-7,7-dimethyl-9-[4-(pentyloxy)phenyl]-10-sulfanylidene-9,10-dihydro-7H-pyrrolo[3,2,1-ij][1,2]thiazolo[5,4-c]quinoline-4,5-dione |
| Molecular Weight: | 494.63 |
| Molecular Formula: | C26 H26 N2 O4 S2 |
| Smiles: | CCCCCOc1ccc(cc1)N1C(C2=C(C(C)(C)N3C(C(c4cc(cc2c34)OC)=O)=O)S1)=S |
| Stereo: | ACHIRAL |
| logP: | 5.9892 |
| logD: | 5.9633 |
| logSw: | -5.3162 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 47.735 |
| InChI Key: | YPUFAQZVOYVCGM-UHFFFAOYSA-N |