N-(5-{[(6,7-dimethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide
Chemical Structure Depiction of
N-(5-{[(6,7-dimethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide
N-(5-{[(6,7-dimethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide
Compound characteristics
Compound ID: | L784-0123 |
Compound Name: | N-(5-{[(6,7-dimethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide |
Molecular Weight: | 389.5 |
Molecular Formula: | C17 H19 N5 O2 S2 |
Smiles: | CC(C)C(Nc1nnc(SCC2C(Nc3cc(C)c(C)cc3N=2)=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 3.8817 |
logD: | 3.879 |
logSw: | -3.9361 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 79.125 |
InChI Key: | JZHDPRITNGCLNZ-UHFFFAOYSA-N |