N-(3-chloro-4-methylphenyl)-2-[(9-phenylpyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-[(9-phenylpyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl)sulfanyl]acetamide
N-(3-chloro-4-methylphenyl)-2-[(9-phenylpyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl)sulfanyl]acetamide
Compound characteristics
Compound ID: | F831-0052 |
Compound Name: | N-(3-chloro-4-methylphenyl)-2-[(9-phenylpyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl)sulfanyl]acetamide |
Molecular Weight: | 448.93 |
Molecular Formula: | C22 H17 Cl N6 O S |
Smiles: | Cc1ccc(cc1[Cl])NC(CSc1nnc2c3cc(c4ccccc4)nn3ccn12)=O |
Stereo: | ACHIRAL |
logP: | 4.5059 |
logD: | 4.4354 |
logSw: | -4.6166 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.457 |
InChI Key: | RSQJDUURGBBHJV-UHFFFAOYSA-N |