2-(3-{[2-(2,4-difluoroanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)-N,N-diethylacetamide
Chemical Structure Depiction of
2-(3-{[2-(2,4-difluoroanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)-N,N-diethylacetamide
2-(3-{[2-(2,4-difluoroanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)-N,N-diethylacetamide
Compound characteristics
| Compound ID: | E587-0026 |
| Compound Name: | 2-(3-{[2-(2,4-difluoroanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)-N,N-diethylacetamide |
| Molecular Weight: | 431.5 |
| Molecular Formula: | C22 H23 F2 N3 O2 S |
| Smiles: | CCN(CC)C(Cn1cc(c2ccccc12)SCC(Nc1ccc(cc1F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3304 |
| logD: | 3.3192 |
| logSw: | -3.5043 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.827 |
| InChI Key: | QATLLBGPHVCZOP-UHFFFAOYSA-N |