1-(4-methoxyphenyl)-5-[3-(2-nitrophenyl)prop-2-en-1-ylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(4-methoxyphenyl)-5-[3-(2-nitrophenyl)prop-2-en-1-ylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(4-methoxyphenyl)-5-[3-(2-nitrophenyl)prop-2-en-1-ylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3448-4428 |
| Compound Name: | 1-(4-methoxyphenyl)-5-[3-(2-nitrophenyl)prop-2-en-1-ylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 409.42 |
| Molecular Formula: | C20 H15 N3 O5 S |
| Smiles: | COc1ccc(cc1)N1C(C(=C\C=C\c2ccccc2[N+]([O-])=O)\C(NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0332 |
| logD: | 1.5865 |
| logSw: | -3.716 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.853 |
| InChI Key: | HIDMRGKPCRILQV-UHFFFAOYSA-N |