3-{[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1H-indole
Chemical Structure Depiction of
3-{[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1H-indole
3-{[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1H-indole
Compound characteristics
| Compound ID: | Y500-2636 |
| Compound Name: | 3-{[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-1H-indole |
| Molecular Weight: | 369.48 |
| Molecular Formula: | C20 H23 N3 O2 S |
| Smiles: | Cc1ccc(cc1)S(N1CCN(CC1)Cc1c[nH]c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3094 |
| logD: | 3.1713 |
| logSw: | -3.4952 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.361 |
| InChI Key: | OMDYQKZUZPUTCJ-UHFFFAOYSA-N |