N-(4-nitrophenyl)-6-oxo-2-[3-(trifluoromethyl)anilino]-3,4,5,6-tetrahydropyrimidine-4-carboxamide
Chemical Structure Depiction of
N-(4-nitrophenyl)-6-oxo-2-[3-(trifluoromethyl)anilino]-3,4,5,6-tetrahydropyrimidine-4-carboxamide
N-(4-nitrophenyl)-6-oxo-2-[3-(trifluoromethyl)anilino]-3,4,5,6-tetrahydropyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | F019-5590 |
| Compound Name: | N-(4-nitrophenyl)-6-oxo-2-[3-(trifluoromethyl)anilino]-3,4,5,6-tetrahydropyrimidine-4-carboxamide |
| Molecular Weight: | 421.33 |
| Molecular Formula: | C18 H14 F3 N5 O4 |
| Smiles: | C1C(C(Nc2ccc(cc2)[N+]([O-])=O)=O)NC(Nc2cccc(c2)C(F)(F)F)=NC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9688 |
| logD: | 2.9661 |
| logSw: | -3.5101 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.799 |
| InChI Key: | MOHNBKOOYBJASI-CQSZACIVSA-N |