N-[(4-chlorophenyl)methyl]-3-(3-fluorophenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-3-(3-fluorophenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
N-[(4-chlorophenyl)methyl]-3-(3-fluorophenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Compound characteristics
Compound ID: | E543-0398 |
Compound Name: | N-[(4-chlorophenyl)methyl]-3-(3-fluorophenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide |
Molecular Weight: | 447.85 |
Molecular Formula: | C23 H15 Cl F N5 O2 |
Smiles: | C(c1ccc(cc1)[Cl])NC(c1ccc2C(Nc3c(c4cccc(c4)F)nnn3c2c1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7893 |
logD: | 3.7885 |
logSw: | -4.4903 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 74.644 |
InChI Key: | ZTOAHMKODVDAOZ-UHFFFAOYSA-N |