1-benzyl-5-[(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
1-benzyl-5-[(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
1-benzyl-5-[(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | C639-0165 |
| Compound Name: | 1-benzyl-5-[(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)methylidene]-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 452.91 |
| Molecular Formula: | C23 H17 Cl N2 O4 S |
| Smiles: | C(c1ccccc1)N1C(C(=C/c2ccc(o2)SCc2ccc(cc2)[Cl])\C(NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8599 |
| logD: | 4.8329 |
| logSw: | -5.0475 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.792 |
| InChI Key: | MBHLRDWGIZPSRM-UHFFFAOYSA-N |