4-{[5-(4-bromophenyl)furan-2-yl]methylidene}-5-methyl-2-(3-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-{[5-(4-bromophenyl)furan-2-yl]methylidene}-5-methyl-2-(3-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
4-{[5-(4-bromophenyl)furan-2-yl]methylidene}-5-methyl-2-(3-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y509-0332 |
| Compound Name: | 4-{[5-(4-bromophenyl)furan-2-yl]methylidene}-5-methyl-2-(3-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 421.29 |
| Molecular Formula: | C22 H17 Br N2 O2 |
| Smiles: | CC1/C(=C/c2ccc(c3ccc(cc3)[Br])o2)C(N(c2cccc(C)c2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1137 |
| logD: | 6.1136 |
| logSw: | -5.4967 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.157 |
| InChI Key: | DVFQCMKFECRASO-UHFFFAOYSA-N |