{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}(3,4,6-trimethyl-1-benzofuran-2-yl)methanone--hydrogen chloride (1/1)
Chemical Structure Depiction of
{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}(3,4,6-trimethyl-1-benzofuran-2-yl)methanone--hydrogen chloride (1/1)
{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}(3,4,6-trimethyl-1-benzofuran-2-yl)methanone--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D345-0102 |
| Compound Name: | {4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}(3,4,6-trimethyl-1-benzofuran-2-yl)methanone--hydrogen chloride (1/1) |
| Molecular Weight: | 413.95 |
| Molecular Formula: | C23 H27 N3 O2 |
| Salt: | HCl |
| Smiles: | Cc1cc(C)c2c(C)c(C(N3CCN(CCc4ccccn4)CC3)=O)oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 3.7917 |
| logD: | 3.7718 |
| logSw: | -3.9481 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.474 |
| InChI Key: | OCBLVVFLCCHWRF-UHFFFAOYSA-N |