6-(4-chlorophenyl)-4,4,6-trimethyl-1-[5-oxo-1-(4-phenyl-1,3-thiazol-2-yl)-2-sulfanylideneimidazolidin-4-ylidene]-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one
Chemical Structure Depiction of
6-(4-chlorophenyl)-4,4,6-trimethyl-1-[5-oxo-1-(4-phenyl-1,3-thiazol-2-yl)-2-sulfanylideneimidazolidin-4-ylidene]-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one
6-(4-chlorophenyl)-4,4,6-trimethyl-1-[5-oxo-1-(4-phenyl-1,3-thiazol-2-yl)-2-sulfanylideneimidazolidin-4-ylidene]-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one
Compound characteristics
Compound ID: | Y021-3544 |
Compound Name: | 6-(4-chlorophenyl)-4,4,6-trimethyl-1-[5-oxo-1-(4-phenyl-1,3-thiazol-2-yl)-2-sulfanylideneimidazolidin-4-ylidene]-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one |
Molecular Weight: | 597.16 |
Molecular Formula: | C32 H25 Cl N4 O2 S2 |
Smiles: | CC1(CC(C)(C)N2C(C(=C3/C(N(C(N3)=S)c3nc(cs3)c3ccccc3)=O)/c3cccc1c23)=O)c1ccc(cc1)[Cl] |
Stereo: | RACEMIC MIXTURE |
logP: | 7.0631 |
logD: | 7.0027 |
logSw: | -6.3103 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 53.048 |
InChI Key: | GQWBCHIDBBDCNV-YTTGMZPUSA-N |