(3,6-dimethyl-1-benzofuran-2-yl){4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}methanone--hydrogen chloride (1/1)
Chemical Structure Depiction of
(3,6-dimethyl-1-benzofuran-2-yl){4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}methanone--hydrogen chloride (1/1)
(3,6-dimethyl-1-benzofuran-2-yl){4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}methanone--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D345-0095 |
| Compound Name: | (3,6-dimethyl-1-benzofuran-2-yl){4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}methanone--hydrogen chloride (1/1) |
| Molecular Weight: | 399.92 |
| Molecular Formula: | C22 H25 N3 O2 |
| Salt: | HCl |
| Smiles: | Cc1ccc2c(C)c(C(N3CCN(CCc4ccccn4)CC3)=O)oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 3.4511 |
| logD: | 3.4312 |
| logSw: | -3.6718 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.474 |
| InChI Key: | QHPBXQNAEPJDEI-UHFFFAOYSA-N |