2-[(7-chloro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(4-methylphenyl)acetamide
Chemical Structure Depiction of
2-[(7-chloro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(4-methylphenyl)acetamide
2-[(7-chloro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(4-methylphenyl)acetamide
Compound characteristics
Compound ID: | F367-0608 |
Compound Name: | 2-[(7-chloro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(4-methylphenyl)acetamide |
Molecular Weight: | 441.94 |
Molecular Formula: | C21 H20 Cl N5 O2 S |
Smiles: | CCCN1C(c2cc(ccc2n2c1nnc2SCC(Nc1ccc(C)cc1)=O)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 4.4133 |
logD: | 4.4133 |
logSw: | -4.562 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.711 |
InChI Key: | VUKRHWOEALFLQM-UHFFFAOYSA-N |