N-[(4-fluorophenyl)methyl]-4-[(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-4-[(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzamide
N-[(4-fluorophenyl)methyl]-4-[(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzamide
Compound characteristics
Compound ID: | K284-4412 |
Compound Name: | N-[(4-fluorophenyl)methyl]-4-[(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzamide |
Molecular Weight: | 419.48 |
Molecular Formula: | C23 H18 F N3 O2 S |
Smiles: | C(c1ccc(cc1)F)NC(c1ccc(CN2C(c3ccccc3NC2=S)=O)cc1)=O |
Stereo: | ACHIRAL |
logP: | 3.9852 |
logD: | 3.9849 |
logSw: | -4.3624 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 51.731 |
InChI Key: | MPTNRVJSOVIRIZ-UHFFFAOYSA-N |