1-(azepan-1-yl)-2-(3-{[(4-bromophenyl)methyl]sulfanyl}-1H-indol-1-yl)ethan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-2-(3-{[(4-bromophenyl)methyl]sulfanyl}-1H-indol-1-yl)ethan-1-one
1-(azepan-1-yl)-2-(3-{[(4-bromophenyl)methyl]sulfanyl}-1H-indol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | E587-0460 |
| Compound Name: | 1-(azepan-1-yl)-2-(3-{[(4-bromophenyl)methyl]sulfanyl}-1H-indol-1-yl)ethan-1-one |
| Molecular Weight: | 457.43 |
| Molecular Formula: | C23 H25 Br N2 O S |
| Smiles: | C1CCCN(CC1)C(Cn1cc(c2ccccc12)SCc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1883 |
| logD: | 5.1883 |
| logSw: | -5.2488 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 18.4225 |
| InChI Key: | SZQOFYPLJKCBSM-UHFFFAOYSA-N |