2-ethyl-N-(2-{[2-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)butanamide
Chemical Structure Depiction of
2-ethyl-N-(2-{[2-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)butanamide
2-ethyl-N-(2-{[2-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)butanamide
Compound characteristics
| Compound ID: | D336-1726 |
| Compound Name: | 2-ethyl-N-(2-{[2-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)butanamide |
| Molecular Weight: | 453.62 |
| Molecular Formula: | C24 H27 N3 O2 S2 |
| Smiles: | CCC(CC)C(Nc1ccc2c(c1)sc(n2)SCC(N1C(C)Cc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4704 |
| logD: | 5.4703 |
| logSw: | -5.2915 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.773 |
| InChI Key: | DAZCHGJYFVDPLP-HNNXBMFYSA-N |