3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(4-chlorophenyl)-N-phenyl-1,3-thiazol-2(3H)-imine--hydrogen bromide (1/1)
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(4-chlorophenyl)-N-phenyl-1,3-thiazol-2(3H)-imine--hydrogen bromide (1/1)
3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(4-chlorophenyl)-N-phenyl-1,3-thiazol-2(3H)-imine--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 8009-1980 |
| Compound Name: | 3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(4-chlorophenyl)-N-phenyl-1,3-thiazol-2(3H)-imine--hydrogen bromide (1/1) |
| Molecular Weight: | 501.83 |
| Molecular Formula: | C23 H17 Cl N2 O2 S |
| Salt: | HBr |
| Smiles: | C(c1ccc2c(c1)OCO2)N1C(=CSC/1=N/c1ccccc1)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.4366 |
| logD: | 6.4365 |
| logSw: | -6.5512 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.4186 |
| InChI Key: | AFNTXNNVYVGGKX-BZZOAKBMSA-N |