N-(3-chlorophenyl)-2-({4-oxo-2-[4-(propan-2-yl)phenyl]-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-2-({4-oxo-2-[4-(propan-2-yl)phenyl]-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl}sulfanyl)acetamide
N-(3-chlorophenyl)-2-({4-oxo-2-[4-(propan-2-yl)phenyl]-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | F424-0363 |
| Compound Name: | N-(3-chlorophenyl)-2-({4-oxo-2-[4-(propan-2-yl)phenyl]-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl}sulfanyl)acetamide |
| Molecular Weight: | 453.95 |
| Molecular Formula: | C22 H20 Cl N5 O2 S |
| Smiles: | CC(C)c1ccc(cc1)c1cc2C(NN=C(n2n1)SCC(Nc1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5785 |
| logD: | 5.577 |
| logSw: | -6.1091 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.464 |
| InChI Key: | VJKNYCUCMGZIKH-UHFFFAOYSA-N |