N-[2-(3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1H-indol-1-yl)ethyl]-4-methoxybenzamide
Chemical Structure Depiction of
N-[2-(3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1H-indol-1-yl)ethyl]-4-methoxybenzamide
N-[2-(3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1H-indol-1-yl)ethyl]-4-methoxybenzamide
Compound characteristics
| Compound ID: | C064-0011 |
| Compound Name: | N-[2-(3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-1H-indol-1-yl)ethyl]-4-methoxybenzamide |
| Molecular Weight: | 468.98 |
| Molecular Formula: | C25 H22 Cl F N2 O2 S |
| Smiles: | COc1ccc(cc1)C(NCCn1cc(c2ccccc12)SCc1c(cccc1[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4241 |
| logD: | 5.4241 |
| logSw: | -5.9558 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.748 |
| InChI Key: | JKRCEJOZKCXEJH-UHFFFAOYSA-N |