1-ethyl-6-methyl-2-[(3-methyl-4-phenyl-1,3-thiazol-2(3H)-ylidene)methyl]quinolin-1-ium--iodide (1/1)
Chemical Structure Depiction of
1-ethyl-6-methyl-2-[(3-methyl-4-phenyl-1,3-thiazol-2(3H)-ylidene)methyl]quinolin-1-ium--iodide (1/1)
1-ethyl-6-methyl-2-[(3-methyl-4-phenyl-1,3-thiazol-2(3H)-ylidene)methyl]quinolin-1-ium--iodide (1/1)
Compound characteristics
| Compound ID: | 3853-0155 |
| Compound Name: | 1-ethyl-6-methyl-2-[(3-methyl-4-phenyl-1,3-thiazol-2(3H)-ylidene)methyl]quinolin-1-ium--iodide (1/1) |
| Molecular Weight: | 486.42 |
| Molecular Formula: | C23 H23 N2 S |
| Salt: | I- |
| Smiles: | CC[n+]1c(/C=C2/N(C)C(=CS2)c2ccccc2)ccc2cc(C)ccc12 |
| Stereo: | ACHIRAL |
| logP: | 6.2847 |
| logD: | 6.2847 |
| logSw: | -5.9534 |
| Hydrogen bond acceptors count: | 1 |
| Polar surface area: | 1.5531 |
| InChI Key: | ROEJSJKXEXNRII-UHFFFAOYSA-N |