5-{[1-([1,1'-biphenyl]-4-yl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[1-([1,1'-biphenyl]-4-yl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione
5-{[1-([1,1'-biphenyl]-4-yl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 2368-0312 |
| Compound Name: | 5-{[1-([1,1'-biphenyl]-4-yl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 495.96 |
| Molecular Formula: | C29 H22 Cl N3 O3 |
| Smiles: | Cc1cc(/C=C2/C(NC(N(C2=O)c2ccc(cc2)[Cl])=O)=O)c(C)n1c1ccc(cc1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4461 |
| logD: | 5.3659 |
| logSw: | -6.0241 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.784 |
| InChI Key: | KAPPXOMFUXQHDL-UHFFFAOYSA-N |