7-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-N-(2-nitrophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
7-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-N-(2-nitrophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
7-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-N-(2-nitrophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
Compound ID: | Y502-2570 |
Compound Name: | 7-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-N-(2-nitrophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
Molecular Weight: | 391.39 |
Molecular Formula: | C19 H17 N7 O3 |
Smiles: | CCn1c(C)c(cn1)c1ccnc2cc(C(Nc3ccccc3[N+]([O-])=O)=O)nn12 |
Stereo: | ACHIRAL |
logP: | 2.5096 |
logD: | 2.3357 |
logSw: | -2.934 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 88.229 |
InChI Key: | QPLJMHJLJPIENR-UHFFFAOYSA-N |