1-(2,3-dichlorophenyl)-5-{[4-(1,3-dihydro-2H-isoindol-2-yl)phenyl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(2,3-dichlorophenyl)-5-{[4-(1,3-dihydro-2H-isoindol-2-yl)phenyl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(2,3-dichlorophenyl)-5-{[4-(1,3-dihydro-2H-isoindol-2-yl)phenyl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 4243-1245 |
| Compound Name: | 1-(2,3-dichlorophenyl)-5-{[4-(1,3-dihydro-2H-isoindol-2-yl)phenyl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 494.4 |
| Molecular Formula: | C25 H17 Cl2 N3 O2 S |
| Smiles: | C1c2ccccc2CN1c1ccc(/C=C2/C(NC(N(C2=O)c2cccc(c2[Cl])[Cl])=S)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.689 |
| logD: | 3.7093 |
| logSw: | -6.0269 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.341 |
| InChI Key: | ALYRLUGGOONALC-UHFFFAOYSA-N |