N-[2-(3-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)ethyl]-2-methoxybenzamide
Chemical Structure Depiction of
N-[2-(3-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)ethyl]-2-methoxybenzamide
N-[2-(3-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)ethyl]-2-methoxybenzamide
Compound characteristics
| Compound ID: | C064-0113 |
| Compound Name: | N-[2-(3-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-1H-indol-1-yl)ethyl]-2-methoxybenzamide |
| Molecular Weight: | 519.62 |
| Molecular Formula: | C28 H29 N3 O5 S |
| Smiles: | COc1ccc(c(c1)OC)NC(CSc1cn(CCNC(c2ccccc2OC)=O)c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9586 |
| logD: | 3.9584 |
| logSw: | -3.9305 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.46 |
| InChI Key: | WAUPSPCHXJHLNO-UHFFFAOYSA-N |