N-(3-chloro-4-methylphenyl)-2-{[2-(4-methoxyphenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-{[2-(4-methoxyphenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
N-(3-chloro-4-methylphenyl)-2-{[2-(4-methoxyphenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C200-6229 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-{[2-(4-methoxyphenyl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide |
| Molecular Weight: | 455.92 |
| Molecular Formula: | C21 H18 Cl N5 O3 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(CSC1=NNC(c2cc(c3ccc(cc3)OC)nn12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8594 |
| logD: | 4.8578 |
| logSw: | -4.9566 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.007 |
| InChI Key: | MONSBKOUQKSFHE-UHFFFAOYSA-N |