5-{[4-(benzyloxy)-5-methoxy-2-nitrophenyl]methylidene}-1-(4-tert-butylphenyl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[4-(benzyloxy)-5-methoxy-2-nitrophenyl]methylidene}-1-(4-tert-butylphenyl)-1,3-diazinane-2,4,6-trione
5-{[4-(benzyloxy)-5-methoxy-2-nitrophenyl]methylidene}-1-(4-tert-butylphenyl)-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 3269-0493 |
| Compound Name: | 5-{[4-(benzyloxy)-5-methoxy-2-nitrophenyl]methylidene}-1-(4-tert-butylphenyl)-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 529.55 |
| Molecular Formula: | C29 H27 N3 O7 |
| Smiles: | CC(C)(C)c1ccc(cc1)N1C(C(=C\c2cc(c(cc2[N+]([O-])=O)OCc2ccccc2)OC)\C(NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7844 |
| logD: | 4.3869 |
| logSw: | -4.7919 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.416 |
| InChI Key: | XCVWUQBLQLEUMR-UHFFFAOYSA-N |