5-{[4-(benzyloxy)-5-methoxy-2-nitrophenyl]methylidene}-1,3-dimethyl-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[4-(benzyloxy)-5-methoxy-2-nitrophenyl]methylidene}-1,3-dimethyl-1,3-diazinane-2,4,6-trione
5-{[4-(benzyloxy)-5-methoxy-2-nitrophenyl]methylidene}-1,3-dimethyl-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 8007-0764 |
| Compound Name: | 5-{[4-(benzyloxy)-5-methoxy-2-nitrophenyl]methylidene}-1,3-dimethyl-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 425.4 |
| Molecular Formula: | C21 H19 N3 O7 |
| Smiles: | CN1C(C(=Cc2cc(c(cc2[N+]([O-])=O)OCc2ccccc2)OC)C(N(C)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.341 |
| logD: | 2.341 |
| logSw: | -2.8587 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 93.151 |
| InChI Key: | QXJQOMZIFKLEHQ-UHFFFAOYSA-N |