5-oxo-N-[(oxolan-2-yl)methyl]-1-sulfanylidene-4,5-dihydro-1H,8H-[1,3]dioxolo[4,5-g][1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Chemical Structure Depiction of
5-oxo-N-[(oxolan-2-yl)methyl]-1-sulfanylidene-4,5-dihydro-1H,8H-[1,3]dioxolo[4,5-g][1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
5-oxo-N-[(oxolan-2-yl)methyl]-1-sulfanylidene-4,5-dihydro-1H,8H-[1,3]dioxolo[4,5-g][1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Compound characteristics
Compound ID: | F083-0416 |
Compound Name: | 5-oxo-N-[(oxolan-2-yl)methyl]-1-sulfanylidene-4,5-dihydro-1H,8H-[1,3]dioxolo[4,5-g][1,3]thiazolo[3,4-a]quinazoline-3-carboxamide |
Molecular Weight: | 405.45 |
Molecular Formula: | C17 H15 N3 O5 S2 |
Smiles: | C1CC(CNC(C2=C3NC(c4cc5c(cc4N3C(=S)S2)OCO5)=O)=O)OC1 |
Stereo: | RACEMIC MIXTURE |
logP: | 1.3654 |
logD: | 1.3654 |
logSw: | -2.5251 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 77.159 |
InChI Key: | MRFQUEGRBLKUNI-MRVPVSSYSA-N |