1-ethyl-5-[3-(2-nitrophenyl)prop-2-en-1-ylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-ethyl-5-[3-(2-nitrophenyl)prop-2-en-1-ylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
1-ethyl-5-[3-(2-nitrophenyl)prop-2-en-1-ylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3448-7427 |
| Compound Name: | 1-ethyl-5-[3-(2-nitrophenyl)prop-2-en-1-ylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 331.35 |
| Molecular Formula: | C15 H13 N3 O4 S |
| Smiles: | CCN1C(C(=C/C=C\c2ccccc2[N+]([O-])=O)\C(NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1578 |
| logD: | 1.3688 |
| logSw: | -2.7188 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.917 |
| InChI Key: | LQMOGSZBRIMXNJ-UHFFFAOYSA-N |