{4-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]piperazin-1-yl}(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone
Chemical Structure Depiction of
{4-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]piperazin-1-yl}(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone
{4-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]piperazin-1-yl}(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone
Compound characteristics
| Compound ID: | Y501-2650 |
| Compound Name: | {4-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]piperazin-1-yl}(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone |
| Molecular Weight: | 386.56 |
| Molecular Formula: | C21 H30 N4 O S |
| Smiles: | CCn1c(C)c(CN2CCN(CC2)C(c2cc3CCCCc3s2)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.8334 |
| logD: | 0.0816 |
| logSw: | -2.9969 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.644 |
| InChI Key: | GFKNWQXNJSAWTF-UHFFFAOYSA-N |