4-{[5-(4-chlorophenyl)-2-oxofuran-3(2H)-ylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-{[5-(4-chlorophenyl)-2-oxofuran-3(2H)-ylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
4-{[5-(4-chlorophenyl)-2-oxofuran-3(2H)-ylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8014-4852 |
| Compound Name: | 4-{[5-(4-chlorophenyl)-2-oxofuran-3(2H)-ylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 393.83 |
| Molecular Formula: | C21 H16 Cl N3 O3 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)/N=C1/C=C(c2ccc(cc2)[Cl])OC1=O |
| Stereo: | ACHIRAL |
| logP: | 3.2314 |
| logD: | 3.2314 |
| logSw: | -3.9208 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.863 |
| InChI Key: | KASHGOAVWWYHRV-UHFFFAOYSA-N |