1-(2,3-dichlorophenyl)-5-{[5-(piperidin-1-yl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(2,3-dichlorophenyl)-5-{[5-(piperidin-1-yl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(2,3-dichlorophenyl)-5-{[5-(piperidin-1-yl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3679-1418 |
| Compound Name: | 1-(2,3-dichlorophenyl)-5-{[5-(piperidin-1-yl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 450.34 |
| Molecular Formula: | C20 H17 Cl2 N3 O3 S |
| Smiles: | C1CCN(CC1)c1ccc(\C=C2/C(NC(N(C2=O)c2cccc(c2[Cl])[Cl])=S)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.4498 |
| logD: | 2.4512 |
| logSw: | -4.4505 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.829 |
| InChI Key: | NTNHDRHOJBNCBK-UHFFFAOYSA-N |