{3-[(4-chlorophenyl)sulfanyl]-1H-indol-2-yl}(4-ethylpiperazin-1-yl)methanone
Chemical Structure Depiction of
{3-[(4-chlorophenyl)sulfanyl]-1H-indol-2-yl}(4-ethylpiperazin-1-yl)methanone
{3-[(4-chlorophenyl)sulfanyl]-1H-indol-2-yl}(4-ethylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | E018-0635 |
| Compound Name: | {3-[(4-chlorophenyl)sulfanyl]-1H-indol-2-yl}(4-ethylpiperazin-1-yl)methanone |
| Molecular Weight: | 399.94 |
| Molecular Formula: | C21 H22 Cl N3 O S |
| Smiles: | CCN1CCN(CC1)C(c1c(c2ccccc2[nH]1)Sc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0771 |
| logD: | 3.9004 |
| logSw: | -4.3597 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.2714 |
| InChI Key: | JELDVLGTDIEUIR-UHFFFAOYSA-N |