3-chloro-6-methyl-N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]-1-benzothiophene-2-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-chloro-6-methyl-N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]-1-benzothiophene-2-carboxamide--hydrogen chloride (1/1)
3-chloro-6-methyl-N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]-1-benzothiophene-2-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D388-0527 |
| Compound Name: | 3-chloro-6-methyl-N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]-1-benzothiophene-2-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 441.44 |
| Molecular Formula: | C20 H21 Cl N2 O S2 |
| Salt: | HCl |
| Smiles: | [H]N(CC(c1cccs1)N1CCCC1)C(c1c(c2ccc(C)cc2s1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9261 |
| logD: | 4.3913 |
| logSw: | -5.0346 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.7722 |
| InChI Key: | ZPQUHRVAQXOOJW-HNNXBMFYSA-N |