2-(3-{3-benzyl-2-[(4-fluorophenyl)imino]-2,3-dihydro-1,3-thiazol-4-yl}phenyl)-1H-isoindole-1,3(2H)-dione--hydrogen bromide (1/1)
Chemical Structure Depiction of
2-(3-{3-benzyl-2-[(4-fluorophenyl)imino]-2,3-dihydro-1,3-thiazol-4-yl}phenyl)-1H-isoindole-1,3(2H)-dione--hydrogen bromide (1/1)
2-(3-{3-benzyl-2-[(4-fluorophenyl)imino]-2,3-dihydro-1,3-thiazol-4-yl}phenyl)-1H-isoindole-1,3(2H)-dione--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 8009-1203 |
| Compound Name: | 2-(3-{3-benzyl-2-[(4-fluorophenyl)imino]-2,3-dihydro-1,3-thiazol-4-yl}phenyl)-1H-isoindole-1,3(2H)-dione--hydrogen bromide (1/1) |
| Molecular Weight: | 586.48 |
| Molecular Formula: | C30 H20 F N3 O2 S |
| Salt: | HBr |
| Smiles: | C(c1ccccc1)N1C(=CSC/1=N/c1ccc(cc1)F)c1cccc(c1)N1C(c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7169 |
| logD: | 6.7168 |
| logSw: | -6.2028 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.944 |
| InChI Key: | XWHOWFWTLZTCPB-GCUVURNUSA-N |