5-{[5-(3-methyl-4-nitrophenyl)furan-2-yl]methylidene}-1-(prop-2-en-1-yl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[5-(3-methyl-4-nitrophenyl)furan-2-yl]methylidene}-1-(prop-2-en-1-yl)-1,3-diazinane-2,4,6-trione
5-{[5-(3-methyl-4-nitrophenyl)furan-2-yl]methylidene}-1-(prop-2-en-1-yl)-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 2151-0753 |
| Compound Name: | 5-{[5-(3-methyl-4-nitrophenyl)furan-2-yl]methylidene}-1-(prop-2-en-1-yl)-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 381.34 |
| Molecular Formula: | C19 H15 N3 O6 |
| Smiles: | Cc1cc(ccc1[N+]([O-])=O)c1ccc(\C=C2/C(NC(N(CC=C)C2=O)=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.3052 |
| logD: | 3.2504 |
| logSw: | -3.5959 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.903 |
| InChI Key: | KBQKLCGJJOWDGX-UHFFFAOYSA-N |