N,N-diethyl-2-(3-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)acetamide
Chemical Structure Depiction of
N,N-diethyl-2-(3-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)acetamide
N,N-diethyl-2-(3-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)acetamide
Compound characteristics
| Compound ID: | E587-0022 |
| Compound Name: | N,N-diethyl-2-(3-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)acetamide |
| Molecular Weight: | 413.51 |
| Molecular Formula: | C22 H24 F N3 O2 S |
| Smiles: | CCN(CC)C(Cn1cc(c2ccccc12)SCC(Nc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4436 |
| logD: | 3.4434 |
| logSw: | -3.5672 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.525 |
| InChI Key: | QWHFUTWCEDGSJB-UHFFFAOYSA-N |