2-(benzylsulfanyl)-N,N-diethyl-3-(4-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-(benzylsulfanyl)-N,N-diethyl-3-(4-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
2-(benzylsulfanyl)-N,N-diethyl-3-(4-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
Compound ID: | G858-0540 |
Compound Name: | 2-(benzylsulfanyl)-N,N-diethyl-3-(4-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
Molecular Weight: | 461.56 |
Molecular Formula: | C26 H24 F N3 O2 S |
Smiles: | CCN(CC)C(c1ccc2C(N(C(=Nc2c1)SCc1ccccc1)c1ccc(cc1)F)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7275 |
logD: | 3.7273 |
logSw: | -3.9911 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 41.092 |
InChI Key: | HJDRBJRMIVRCSU-UHFFFAOYSA-N |