N-[2-(3-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)ethyl]-2,6-difluorobenzamide
Chemical Structure Depiction of
N-[2-(3-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)ethyl]-2,6-difluorobenzamide
N-[2-(3-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)ethyl]-2,6-difluorobenzamide
Compound characteristics
| Compound ID: | C064-0398 |
| Compound Name: | N-[2-(3-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)ethyl]-2,6-difluorobenzamide |
| Molecular Weight: | 525.57 |
| Molecular Formula: | C27 H25 F2 N3 O4 S |
| Smiles: | COc1ccc(c(c1)OC)NC(CSc1cn(CCNC(c2c(cccc2F)F)=O)c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0033 |
| logD: | 4.0031 |
| logSw: | -4.2385 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.829 |
| InChI Key: | INVZMICABIXOTC-UHFFFAOYSA-N |