4-({[(furan-2-yl)methyl]amino}methylidene)-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-({[(furan-2-yl)methyl]amino}methylidene)-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
4-({[(furan-2-yl)methyl]amino}methylidene)-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 4302-2497 |
| Compound Name: | 4-({[(furan-2-yl)methyl]amino}methylidene)-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 418.41 |
| Molecular Formula: | C22 H18 N4 O5 |
| Smiles: | COc1ccc(cc1)C1/C(=C/NCc2ccco2)C(N(c2ccc(cc2)[N+]([O-])=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1433 |
| logD: | 3.1433 |
| logSw: | -3.4402 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.948 |
| InChI Key: | LFTVEFSUSONJDZ-UHFFFAOYSA-N |