N-(4-chlorophenyl)-2-({4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-2-({4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}sulfanyl)acetamide
N-(4-chlorophenyl)-2-({4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | F367-0220 |
| Compound Name: | N-(4-chlorophenyl)-2-({4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}sulfanyl)acetamide |
| Molecular Weight: | 493.95 |
| Molecular Formula: | C24 H17 Cl F N5 O2 S |
| Smiles: | C(c1ccc(cc1)F)N1C(c2ccccc2n2c1nnc2SCC(Nc1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5187 |
| logD: | 4.5186 |
| logSw: | -4.8524 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.461 |
| InChI Key: | YRTUCBFNUNKBTN-UHFFFAOYSA-N |