5-chloro-2-[(2-chloroanilino)methyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
5-chloro-2-[(2-chloroanilino)methyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
5-chloro-2-[(2-chloroanilino)methyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 4644-0419 |
| Compound Name: | 5-chloro-2-[(2-chloroanilino)methyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 325.19 |
| Molecular Formula: | C15 H14 Cl2 N2 O2 |
| Smiles: | C1C=C(CC2C1C(N(CNc1ccccc1[Cl])C2=O)=O)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9424 |
| logD: | 2.9424 |
| logSw: | -3.4001 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.145 |
| InChI Key: | SWMNCWFGWQDKHO-UHFFFAOYSA-N |