N-[2-(3-{[(4-bromophenyl)methyl]sulfanyl}-1H-indol-1-yl)ethyl]-4-methoxybenzamide
Chemical Structure Depiction of
N-[2-(3-{[(4-bromophenyl)methyl]sulfanyl}-1H-indol-1-yl)ethyl]-4-methoxybenzamide
N-[2-(3-{[(4-bromophenyl)methyl]sulfanyl}-1H-indol-1-yl)ethyl]-4-methoxybenzamide
Compound characteristics
| Compound ID: | C064-0001 |
| Compound Name: | N-[2-(3-{[(4-bromophenyl)methyl]sulfanyl}-1H-indol-1-yl)ethyl]-4-methoxybenzamide |
| Molecular Weight: | 495.44 |
| Molecular Formula: | C25 H23 Br N2 O2 S |
| Smiles: | COc1ccc(cc1)C(NCCn1cc(c2ccccc12)SCc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2313 |
| logD: | 5.2313 |
| logSw: | -5.1069 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.748 |
| InChI Key: | FQRHANHUMJBSQG-UHFFFAOYSA-N |