5-[(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-[(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
5-[(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | C639-0040 |
| Compound Name: | 5-[(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)methylidene]-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 362.79 |
| Molecular Formula: | C16 H11 Cl N2 O4 S |
| Smiles: | C(c1ccc(cc1)[Cl])Sc1ccc(C=C2C(NC(NC2=O)=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.8352 |
| logD: | 2.4774 |
| logSw: | -3.5551 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.433 |
| InChI Key: | DBYNZLLTKLHPNU-UHFFFAOYSA-N |