N-(2,5-difluorophenyl)-2-[(5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2,5-difluorophenyl)-2-[(5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetamide
N-(2,5-difluorophenyl)-2-[(5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetamide
Compound characteristics
Compound ID: | F367-0030 |
Compound Name: | N-(2,5-difluorophenyl)-2-[(5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetamide |
Molecular Weight: | 429.45 |
Molecular Formula: | C20 H17 F2 N5 O2 S |
Smiles: | CCCN1C(c2ccccc2n2c1nnc2SCC(Nc1cc(ccc1F)F)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.2495 |
logD: | 3.2414 |
logSw: | -3.6309 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.014 |
InChI Key: | ALDKVDXFKRKDCN-UHFFFAOYSA-N |