1-(3-bromophenyl)-5-{[5-(4-methyl-3-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
1-(3-bromophenyl)-5-{[5-(4-methyl-3-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
1-(3-bromophenyl)-5-{[5-(4-methyl-3-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 3685-1447 |
| Compound Name: | 1-(3-bromophenyl)-5-{[5-(4-methyl-3-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 496.27 |
| Molecular Formula: | C22 H14 Br N3 O6 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)c1ccc(\C=C2/C(NC(N(C2=O)c2cccc(c2)[Br])=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.6252 |
| logD: | 3.6178 |
| logSw: | -4.4939 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.041 |
| InChI Key: | QASBDONAYVWLNP-UHFFFAOYSA-N |