1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[5-chloro-2-(thiophen-2-yl)-1H-indol-1-yl]ethan-1-one
Chemical Structure Depiction of
1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[5-chloro-2-(thiophen-2-yl)-1H-indol-1-yl]ethan-1-one
1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[5-chloro-2-(thiophen-2-yl)-1H-indol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | E629-1668 |
| Compound Name: | 1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[5-chloro-2-(thiophen-2-yl)-1H-indol-1-yl]ethan-1-one |
| Molecular Weight: | 494.01 |
| Molecular Formula: | C26 H24 Cl N3 O3 S |
| Smiles: | C1CN(CCN1Cc1ccc2c(c1)OCO2)C(Cn1c(cc2cc(ccc12)[Cl])c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1217 |
| logD: | 4.9302 |
| logSw: | -5.5208 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.488 |
| InChI Key: | HOVMFASHLWKXNG-UHFFFAOYSA-N |