3-ethyl-6-{4-[3-(1H-indol-3-yl)propanoyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
3-ethyl-6-{4-[3-(1H-indol-3-yl)propanoyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
3-ethyl-6-{4-[3-(1H-indol-3-yl)propanoyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0398 |
| Compound Name: | 3-ethyl-6-{4-[3-(1H-indol-3-yl)propanoyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 498.62 |
| Molecular Formula: | C24 H26 N4 O4 S2 |
| Smiles: | CCN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)C(CCc1c[nH]c2ccccc12)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6124 |
| logD: | 3.6124 |
| logSw: | -3.9276 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.318 |
| InChI Key: | KVFICXHUEJDEPY-UHFFFAOYSA-N |