2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enamide
Chemical Structure Depiction of
2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enamide
2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enamide
Compound characteristics
| Compound ID: | 1187-2025 |
| Compound Name: | 2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enamide |
| Molecular Weight: | 469.46 |
| Molecular Formula: | C25 H19 N5 O5 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NC(C(=C/c1ccc(c2cccc(c2)[N+]([O-])=O)o1)\C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1645 |
| logD: | 1.3467 |
| logSw: | -3.5895 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.718 |
| InChI Key: | HRXMYHAWZWGGHB-UHFFFAOYSA-N |