N-(3,4-dichlorophenyl)-3-methyl-4-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3-thiazol-2(3H)-imine--hydrogen bromide (1/1)
Chemical Structure Depiction of
N-(3,4-dichlorophenyl)-3-methyl-4-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3-thiazol-2(3H)-imine--hydrogen bromide (1/1)
N-(3,4-dichlorophenyl)-3-methyl-4-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3-thiazol-2(3H)-imine--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 4386-3862 |
| Compound Name: | N-(3,4-dichlorophenyl)-3-methyl-4-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3-thiazol-2(3H)-imine--hydrogen bromide (1/1) |
| Molecular Weight: | 549.33 |
| Molecular Formula: | C20 H19 Cl2 N3 O2 S2 |
| Salt: | HBr |
| Smiles: | CN1C(=CSC/1=N/c1ccc(c(c1)[Cl])[Cl])c1ccc(cc1)S(N1CCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.538 |
| logD: | 5.538 |
| logSw: | -6.073 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 43.417 |
| InChI Key: | GAPMSPHFJRREGT-ATJXCDBQSA-N |