N~8~-(butan-2-yl)-5-oxo-N~3~-(propan-2-yl)-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide
Chemical Structure Depiction of
N~8~-(butan-2-yl)-5-oxo-N~3~-(propan-2-yl)-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide
N~8~-(butan-2-yl)-5-oxo-N~3~-(propan-2-yl)-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide
Compound characteristics
Compound ID: | K233-0912 |
Compound Name: | N~8~-(butan-2-yl)-5-oxo-N~3~-(propan-2-yl)-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide |
Molecular Weight: | 418.54 |
Molecular Formula: | C19 H22 N4 O3 S2 |
Smiles: | CCC(C)NC(c1ccc2C(NC3=C(C(NC(C)C)=O)SC(N3c2c1)=S)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.8324 |
logD: | 1.8324 |
logSw: | -2.724 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 74.761 |
InChI Key: | BAGVIZHSNSPVMV-JTQLQIEISA-N |