N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(3,4-dichlorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(3,4-dichlorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(3,4-dichlorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
Compound ID: | K061-0997 |
Compound Name: | N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(3,4-dichlorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
Molecular Weight: | 550.39 |
Molecular Formula: | C24 H16 Cl2 F3 N5 O S |
Smiles: | CC1CCc2c(C#N)c(NC(c3cc4nc(cc(C(F)(F)F)n4n3)c3ccc(c(c3)[Cl])[Cl])=O)sc2C1 |
Stereo: | RACEMIC MIXTURE |
logP: | 7.2598 |
logD: | 5.6338 |
logSw: | -6.6997 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.26 |
InChI Key: | DFAFRBUHSCIIAE-LLVKDONJSA-N |