N-[(3,4-dimethoxyphenyl)methyl]-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-[(3,4-dimethoxyphenyl)methyl]-2-({4-oxo-2-[4-(propan-2-yl)phenyl]-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl}sulfanyl)acetamide
N-[(3,4-dimethoxyphenyl)methyl]-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: | F424-0445 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-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: | 493.58 |
| Molecular Formula: | C25 H27 N5 O4 S |
| Smiles: | CC(C)c1ccc(cc1)c1cc2C(NN=C(n2n1)SCC(NCc1ccc(c(c1)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1212 |
| logD: | 4.1196 |
| logSw: | -4.2566 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.047 |
| InChI Key: | MMZPLQMQXRBDFQ-UHFFFAOYSA-N |