N-[2-(3-{[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)ethyl]-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-[2-(3-{[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)ethyl]-3,4-dimethoxybenzamide
N-[2-(3-{[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)ethyl]-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | C064-0511 |
| Compound Name: | N-[2-(3-{[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)ethyl]-3,4-dimethoxybenzamide |
| Molecular Weight: | 507.58 |
| Molecular Formula: | C27 H26 F N3 O4 S |
| Smiles: | COc1ccc(cc1OC)C(NCCn1cc(c2ccccc12)SCC(Nc1ccccc1F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4949 |
| logD: | 3.4947 |
| logSw: | -3.7969 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.916 |
| InChI Key: | SZKRGZPSXFZEDZ-UHFFFAOYSA-N |