N-(2-{[(7-oxo-2-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)furan-2-carboxamide
Chemical Structure Depiction of
N-(2-{[(7-oxo-2-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)furan-2-carboxamide
N-(2-{[(7-oxo-2-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)furan-2-carboxamide
Compound characteristics
| Compound ID: | G647-2555 |
| Compound Name: | N-(2-{[(7-oxo-2-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)furan-2-carboxamide |
| Molecular Weight: | 443.48 |
| Molecular Formula: | C23 H17 N5 O3 S |
| Smiles: | C(C1=CC(N2C(NC(c3ccccc3)=N2)=N1)=O)Sc1ccccc1NC(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.145 |
| logD: | 3.145 |
| logSw: | -3.4277 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.896 |
| InChI Key: | MRBLJZVSLPTLCD-UHFFFAOYSA-N |