N-(2-{3-[(2-anilino-2-oxoethyl)sulfanyl]-1H-indol-1-yl}ethyl)-2,6-difluorobenzamide
Chemical Structure Depiction of
N-(2-{3-[(2-anilino-2-oxoethyl)sulfanyl]-1H-indol-1-yl}ethyl)-2,6-difluorobenzamide
N-(2-{3-[(2-anilino-2-oxoethyl)sulfanyl]-1H-indol-1-yl}ethyl)-2,6-difluorobenzamide
Compound characteristics
| Compound ID: | C064-0364 |
| Compound Name: | N-(2-{3-[(2-anilino-2-oxoethyl)sulfanyl]-1H-indol-1-yl}ethyl)-2,6-difluorobenzamide |
| Molecular Weight: | 465.52 |
| Molecular Formula: | C25 H21 F2 N3 O2 S |
| Smiles: | C(Cn1cc(c2ccccc12)SCC(Nc1ccccc1)=O)NC(c1c(cccc1F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0663 |
| logD: | 4.0662 |
| logSw: | -4.2795 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.353 |
| InChI Key: | KZICEQOEBDDFFS-UHFFFAOYSA-N |