5-[(2-chloro-5-nitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-[(2-chloro-5-nitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
5-[(2-chloro-5-nitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 2237-1807 |
| Compound Name: | 5-[(2-chloro-5-nitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 323.69 |
| Molecular Formula: | C13 H10 Cl N3 O5 |
| Smiles: | CN1C(C(=Cc2cc(ccc2[Cl])[N+]([O-])=O)C(N(C)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2564 |
| logD: | 2.2564 |
| logSw: | -3.1803 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.507 |
| InChI Key: | KJTIXMGARXVJBL-UHFFFAOYSA-N |