2-[(3-ethyl-5-methyl-4-phenyl-1,3-thiazol-2(3H)-ylidene)methyl]-1-methyl-6-phenylquinolin-1-ium--iodide (1/1)
Chemical Structure Depiction of
2-[(3-ethyl-5-methyl-4-phenyl-1,3-thiazol-2(3H)-ylidene)methyl]-1-methyl-6-phenylquinolin-1-ium--iodide (1/1)
2-[(3-ethyl-5-methyl-4-phenyl-1,3-thiazol-2(3H)-ylidene)methyl]-1-methyl-6-phenylquinolin-1-ium--iodide (1/1)
Compound characteristics
| Compound ID: | 7165-0502 |
| Compound Name: | 2-[(3-ethyl-5-methyl-4-phenyl-1,3-thiazol-2(3H)-ylidene)methyl]-1-methyl-6-phenylquinolin-1-ium--iodide (1/1) |
| Molecular Weight: | 562.52 |
| Molecular Formula: | C29 H27 N2 S |
| Salt: | I- |
| Smiles: | CCN1/C(=C/c2ccc3cc(ccc3[n+]2C)c2ccccc2)SC(C)=C1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 8.0285 |
| logD: | 8.0285 |
| logSw: | -6.1313 |
| Hydrogen bond acceptors count: | 1 |
| Polar surface area: | 2.741 |
| InChI Key: | CKIKDFNGZDUCKX-UHFFFAOYSA-N |