4-{[1-(4-chlorophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-{[1-(4-chlorophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
4-{[1-(4-chlorophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 2368-1613 |
| Compound Name: | 4-{[1-(4-chlorophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 514.03 |
| Molecular Formula: | C33 H24 Cl N3 O |
| Smiles: | CC1/C(=C\c2cc(c3ccccc3)n(c3ccc(cc3)[Cl])c2c2ccccc2)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.8606 |
| logD: | 7.8606 |
| logSw: | -6.4499 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.7673 |
| InChI Key: | MHGPRUKCFAKLHN-UHFFFAOYSA-N |