4-(4-chlorophenyl)-3-(prop-2-en-1-yl)-2-(2,4,6-trimethylanilino)-1,3-thiazol-3-ium--bromide (1/1)
Chemical Structure Depiction of
4-(4-chlorophenyl)-3-(prop-2-en-1-yl)-2-(2,4,6-trimethylanilino)-1,3-thiazol-3-ium--bromide (1/1)
4-(4-chlorophenyl)-3-(prop-2-en-1-yl)-2-(2,4,6-trimethylanilino)-1,3-thiazol-3-ium--bromide (1/1)
Compound characteristics
| Compound ID: | 1611-3001 |
| Compound Name: | 4-(4-chlorophenyl)-3-(prop-2-en-1-yl)-2-(2,4,6-trimethylanilino)-1,3-thiazol-3-ium--bromide (1/1) |
| Molecular Weight: | 449.84 |
| Molecular Formula: | C21 H22 Cl N2 S |
| Salt: | Br- |
| Smiles: | [H]N(c1c(C)cc(C)cc1C)c1[n+](CC=C)c(cs1)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.0732 |
| logD: | 7.0732 |
| logSw: | -6.6815 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 8.5872 |
| InChI Key: | AEOVWQPGBUCYTK-UHFFFAOYSA-O |