5-({5-[(4-methylphenyl)sulfanyl]furan-2-yl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-({5-[(4-methylphenyl)sulfanyl]furan-2-yl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-({5-[(4-methylphenyl)sulfanyl]furan-2-yl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3202-0410 |
| Compound Name: | 5-({5-[(4-methylphenyl)sulfanyl]furan-2-yl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 344.41 |
| Molecular Formula: | C16 H12 N2 O3 S2 |
| Smiles: | Cc1ccc(cc1)Sc1ccc(C=C2C(NC(NC2=O)=S)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.1807 |
| logD: | 3.7431 |
| logSw: | -4.2924 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.416 |
| InChI Key: | IHPFDUOMBRKXKL-UHFFFAOYSA-N |