N-(5-{[(6,7-dimethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide
Chemical Structure Depiction of
N-(5-{[(6,7-dimethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide
N-(5-{[(6,7-dimethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide
Compound characteristics
| Compound ID: | L784-0118 |
| Compound Name: | N-(5-{[(6,7-dimethyl-3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide |
| Molecular Weight: | 389.5 |
| Molecular Formula: | C17 H19 N5 O2 S2 |
| Smiles: | CCCC(Nc1nnc(SCC2C(Nc3cc(C)c(C)cc3N=2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7182 |
| logD: | 3.7159 |
| logSw: | -3.9075 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.912 |
| InChI Key: | MPOHXPRRYBFFMV-UHFFFAOYSA-N |