5-[(3-methoxy-4-{2-[(4-methylphenyl)sulfanyl]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-[(3-methoxy-4-{2-[(4-methylphenyl)sulfanyl]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
5-[(3-methoxy-4-{2-[(4-methylphenyl)sulfanyl]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3374-0529 |
| Compound Name: | 5-[(3-methoxy-4-{2-[(4-methylphenyl)sulfanyl]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 428.53 |
| Molecular Formula: | C21 H20 N2 O4 S2 |
| Smiles: | Cc1ccc(cc1)SCCOc1ccc(C=C2C(NC(NC2=O)=S)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.0135 |
| logD: | 3.5879 |
| logSw: | -4.123 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.489 |
| InChI Key: | FKTKOTMIFRKSAK-UHFFFAOYSA-N |