5-{[1-(2-ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[1-(2-ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione
5-{[1-(2-ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 3972-0650 |
| Compound Name: | 5-{[1-(2-ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 427.5 |
| Molecular Formula: | C26 H25 N3 O3 |
| Smiles: | CCc1ccccc1n1c(C)cc(\C=C2/C(NC(N(C2=O)c2cccc(C)c2)=O)=O)c1C |
| Stereo: | ACHIRAL |
| logP: | 4.3611 |
| logD: | 4.3446 |
| logSw: | -4.3075 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.755 |
| InChI Key: | WDMBHTSJBNXSMJ-UHFFFAOYSA-N |