6-{4-[(1H-indol-3-yl)acetyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-{4-[(1H-indol-3-yl)acetyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
6-{4-[(1H-indol-3-yl)acetyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0062 |
| Compound Name: | 6-{4-[(1H-indol-3-yl)acetyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 456.54 |
| Molecular Formula: | C21 H20 N4 O4 S2 |
| Smiles: | C(C(N1CCN(CC1)S(c1ccc2c(c1)SC(N2)=O)(=O)=O)=O)c1c[nH]c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 2.7326 |
| logD: | 2.7109 |
| logSw: | -3.3759 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.897 |
| InChI Key: | PNGAUCGMFIEVJG-UHFFFAOYSA-N |