5-[(4-methoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-[(4-methoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
5-[(4-methoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 8003-4119 |
| Compound Name: | 5-[(4-methoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 277.3 |
| Molecular Formula: | C12 H11 N3 O3 S |
| Smiles: | COc1ccc(cc1)NC=C1C(NC(NC1=O)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6454 |
| logD: | 1.2118 |
| logSw: | -2.1769 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 68.771 |
| InChI Key: | SPGXALLZLKCMAV-UHFFFAOYSA-N |