4-(3-{[5-(4-bromophenyl)furan-2-yl]methylidene}-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl)benzoic acid
Chemical Structure Depiction of
4-(3-{[5-(4-bromophenyl)furan-2-yl]methylidene}-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl)benzoic acid
4-(3-{[5-(4-bromophenyl)furan-2-yl]methylidene}-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl)benzoic acid
Compound characteristics
| Compound ID: | 2150-0146 |
| Compound Name: | 4-(3-{[5-(4-bromophenyl)furan-2-yl]methylidene}-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl)benzoic acid |
| Molecular Weight: | 512.36 |
| Molecular Formula: | C28 H18 Br N O4 |
| Smiles: | C(=C1/C=C(c2ccccc2)N(C1=O)c1ccc(cc1)C(O)=O)/c1ccc(c2ccc(cc2)[Br])o1 |
| Stereo: | ACHIRAL |
| logP: | 7.1151 |
| logD: | 4.7199 |
| logSw: | -6.1785 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.025 |
| InChI Key: | PTNVXMRZJRXBHR-UHFFFAOYSA-N |