N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-7-methyl-5-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-7-methyl-5-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-7-methyl-5-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | 2774-0577 |
| Compound Name: | N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-7-methyl-5-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 513.94 |
| Molecular Formula: | C27 H20 Cl N5 O4 |
| Smiles: | Cc1cc(ccc1[Cl])Oc1cc(cc(c1)[N+]([O-])=O)NC(c1cc2nc(cc(C)n2n1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.1777 |
| logD: | 7.1751 |
| logSw: | -6.4164 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.589 |
| InChI Key: | ZQWLCDVMMMZNEQ-UHFFFAOYSA-N |