N-[2-(3-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)ethyl]-2,6-difluorobenzamide
Chemical Structure Depiction of
N-[2-(3-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)ethyl]-2,6-difluorobenzamide
N-[2-(3-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)ethyl]-2,6-difluorobenzamide
Compound characteristics
Compound ID: | C064-0370 |
Compound Name: | N-[2-(3-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)ethyl]-2,6-difluorobenzamide |
Molecular Weight: | 509.57 |
Molecular Formula: | C27 H25 F2 N3 O3 S |
Smiles: | CCOc1ccc(cc1)NC(CSc1cn(CCNC(c2c(cccc2F)F)=O)c2ccccc12)=O |
Stereo: | ACHIRAL |
logP: | 4.627 |
logD: | 4.6269 |
logSw: | -4.1773 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 56.477 |
InChI Key: | HBJTVJPTWKGIHX-UHFFFAOYSA-N |