2-{3-[2-(3,4-dimethylanilino)-1,3-thiazol-4-yl]phenyl}-1H-isoindole-1,3(2H)-dione--hydrogen bromide (1/1)
Chemical Structure Depiction of
2-{3-[2-(3,4-dimethylanilino)-1,3-thiazol-4-yl]phenyl}-1H-isoindole-1,3(2H)-dione--hydrogen bromide (1/1)
2-{3-[2-(3,4-dimethylanilino)-1,3-thiazol-4-yl]phenyl}-1H-isoindole-1,3(2H)-dione--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 8005-2987 |
| Compound Name: | 2-{3-[2-(3,4-dimethylanilino)-1,3-thiazol-4-yl]phenyl}-1H-isoindole-1,3(2H)-dione--hydrogen bromide (1/1) |
| Molecular Weight: | 506.42 |
| Molecular Formula: | C25 H19 N3 O2 S |
| Salt: | HBr |
| Smiles: | Cc1ccc(cc1C)Nc1nc(cs1)c1cccc(c1)N1C(c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7459 |
| logD: | 6.7459 |
| logSw: | -5.7295 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.567 |
| InChI Key: | GJYHSQWRUIOLJW-UHFFFAOYSA-N |