1,3-dicyclohexyl-5-[(4-nitroanilino)methylidene]-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
1,3-dicyclohexyl-5-[(4-nitroanilino)methylidene]-1,3-diazinane-2,4,6-trione
1,3-dicyclohexyl-5-[(4-nitroanilino)methylidene]-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | Y508-1927 |
| Compound Name: | 1,3-dicyclohexyl-5-[(4-nitroanilino)methylidene]-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 440.5 |
| Molecular Formula: | C23 H28 N4 O5 |
| Smiles: | C1CCC(CC1)N1C(C(=CNc2ccc(cc2)[N+]([O-])=O)C(N(C2CCCCC2)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3566 |
| logD: | 2.2353 |
| logSw: | -4.4112 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.477 |
| InChI Key: | XTBAMOKEOBNIBV-UHFFFAOYSA-N |