3-chloro-N-(2-{[(7-oxo-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
3-chloro-N-(2-{[(7-oxo-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)benzamide
3-chloro-N-(2-{[(7-oxo-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | G647-3173 |
| Compound Name: | 3-chloro-N-(2-{[(7-oxo-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 411.87 |
| Molecular Formula: | C19 H14 Cl N5 O2 S |
| Smiles: | C(C1=CC(N2C(NC=N2)=N1)=O)Sc1ccccc1NC(c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.5107 |
| logD: | 2.5107 |
| logSw: | -3.4296 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.201 |
| InChI Key: | IGZWAUQDMFOVLG-UHFFFAOYSA-N |