7-methyl-N-[3-(3-methylphenoxy)-5-nitrophenyl]-5-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
7-methyl-N-[3-(3-methylphenoxy)-5-nitrophenyl]-5-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
7-methyl-N-[3-(3-methylphenoxy)-5-nitrophenyl]-5-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | K061-0230 |
| Compound Name: | 7-methyl-N-[3-(3-methylphenoxy)-5-nitrophenyl]-5-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 479.49 |
| Molecular Formula: | C27 H21 N5 O4 |
| Smiles: | Cc1cccc(c1)Oc1cc(cc(c1)[N+]([O-])=O)NC(c1cc2nc(cc(C)n2n1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3896 |
| logD: | 6.3871 |
| logSw: | -5.7302 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.589 |
| InChI Key: | IBMMVURXKVBWSZ-UHFFFAOYSA-N |