5-{[5-(3-chloro-4-methylphenyl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-{[5-(3-chloro-4-methylphenyl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
5-{[5-(3-chloro-4-methylphenyl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 8006-9202 |
| Compound Name: | 5-{[5-(3-chloro-4-methylphenyl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 346.79 |
| Molecular Formula: | C16 H11 Cl N2 O3 S |
| Smiles: | Cc1ccc(cc1[Cl])c1ccc(C=C2C(NC(NC2=O)=S)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.2726 |
| logD: | 3.835 |
| logSw: | -4.5633 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.196 |
| InChI Key: | QCCYLNQBCHYTAE-UHFFFAOYSA-N |