N-[7-(4-chlorophenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]furan-2-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[7-(4-chlorophenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]furan-2-carboxamide--hydrogen chloride (1/1)
N-[7-(4-chlorophenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]furan-2-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D413-0040 |
| Compound Name: | N-[7-(4-chlorophenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]furan-2-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 454.31 |
| Molecular Formula: | C22 H16 Cl N5 O2 |
| Salt: | HCl |
| Smiles: | C1C(c2ccc(cc2)[Cl])n2c(NC=1c1ccccc1)nc(NC(c1ccco1)=O)n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8099 |
| logD: | 4.7999 |
| logSw: | -5.2984 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.463 |
| InChI Key: | BODSPLVKHRHMRI-SFHVURJKSA-N |