N-(2,4-dimethylphenyl)-2-{8-[(2,4-dimethylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-2-{8-[(2,4-dimethylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
N-(2,4-dimethylphenyl)-2-{8-[(2,4-dimethylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
Compound characteristics
Compound ID: | M451-2028 |
Compound Name: | N-(2,4-dimethylphenyl)-2-{8-[(2,4-dimethylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide |
Molecular Weight: | 433.53 |
Molecular Formula: | C23 H23 N5 O2 S |
Smiles: | Cc1ccc(c(C)c1)NC(CN1C(N2C=CN=C(C2=N1)Sc1ccc(C)cc1C)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.1315 |
logD: | 4.1315 |
logSw: | -4.1126 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.889 |
InChI Key: | CXFJWXMTNRQQCQ-UHFFFAOYSA-N |