1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-(2,4-dichlorophenoxy)ethan-1-one
Chemical Structure Depiction of
1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-(2,4-dichlorophenoxy)ethan-1-one
1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-(2,4-dichlorophenoxy)ethan-1-one
Compound characteristics
| Compound ID: | D628-0042 |
| Compound Name: | 1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-(2,4-dichlorophenoxy)ethan-1-one |
| Molecular Weight: | 407.32 |
| Molecular Formula: | C19 H16 Cl2 N2 O2 S |
| Smiles: | C1CC(c2nc3ccccc3s2)N(C1)C(COc1ccc(cc1[Cl])[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6145 |
| logD: | 4.6145 |
| logSw: | -4.7167 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.454 |
| InChI Key: | LWRYFUGQLGREDD-HNNXBMFYSA-N |