7,8-dimethoxy-3-(pyrrolidine-1-carbonyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
7,8-dimethoxy-3-(pyrrolidine-1-carbonyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
7,8-dimethoxy-3-(pyrrolidine-1-carbonyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Compound characteristics
Compound ID: | F083-0342 |
Compound Name: | 7,8-dimethoxy-3-(pyrrolidine-1-carbonyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one |
Molecular Weight: | 391.47 |
Molecular Formula: | C17 H17 N3 O4 S2 |
Smiles: | COc1cc2C(NC3=C(C(N4CCCC4)=O)SC(N3c2cc1OC)=S)=O |
Stereo: | ACHIRAL |
logP: | 1.8019 |
logD: | 1.8019 |
logSw: | -2.748 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.251 |
InChI Key: | HLJJKWAWGZVYAU-UHFFFAOYSA-N |