4-[(3-nitro-5-phenoxyphenyl)carbamoyl]phenyl 5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate
Chemical Structure Depiction of
4-[(3-nitro-5-phenoxyphenyl)carbamoyl]phenyl 5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate
4-[(3-nitro-5-phenoxyphenyl)carbamoyl]phenyl 5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate
Compound characteristics
| Compound ID: | 1890-1129 |
| Compound Name: | 4-[(3-nitro-5-phenoxyphenyl)carbamoyl]phenyl 5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate |
| Molecular Weight: | 639.55 |
| Molecular Formula: | C33 H20 F3 N5 O6 |
| Smiles: | c1ccc(cc1)c1cc(C(F)(F)F)n2c(cc(C(=O)Oc3ccc(cc3)C(Nc3cc(cc(c3)Oc3ccccc3)[N+]([O-])=O)=O)n2)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.7648 |
| logD: | 7.7526 |
| logSw: | -6.336 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.996 |
| InChI Key: | TURKKULFCVSNRJ-UHFFFAOYSA-N |