3-(3-fluorophenyl)-7-(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Chemical Structure Depiction of
3-(3-fluorophenyl)-7-(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
3-(3-fluorophenyl)-7-(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Compound characteristics
Compound ID: | 5111-0310 |
Compound Name: | 3-(3-fluorophenyl)-7-(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one |
Molecular Weight: | 394.43 |
Molecular Formula: | C20 H15 F N4 O2 S |
Smiles: | CN1C(C(=C2/C(N3CN(CN=C3S2)c2cccc(c2)F)=O)/c2ccccc12)=O |
Stereo: | ACHIRAL |
logP: | 3.4919 |
logD: | 3.4902 |
logSw: | -3.9193 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 45.012 |
InChI Key: | XDLKOGMAAWBPFI-UHFFFAOYSA-N |