5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-1-(3,5-dimethylphenyl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-1-(3,5-dimethylphenyl)-1,3-diazinane-2,4,6-trione
5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-1-(3,5-dimethylphenyl)-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 2368-0059 |
| Compound Name: | 5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-1-(3,5-dimethylphenyl)-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 465.3 |
| Molecular Formula: | C23 H17 Br N2 O4 |
| Smiles: | Cc1cc(C)cc(c1)N1C(C(=C/c2ccc(c3ccc(cc3)[Br])o2)\C(NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4478 |
| logD: | 5.4315 |
| logSw: | -5.4575 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.96 |
| InChI Key: | KJNBJKBSGQAEOZ-UHFFFAOYSA-N |