1-(azepan-1-yl)-2-{3-[(4-bromophenyl)methanesulfonyl]-1H-indol-1-yl}ethan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-2-{3-[(4-bromophenyl)methanesulfonyl]-1H-indol-1-yl}ethan-1-one
1-(azepan-1-yl)-2-{3-[(4-bromophenyl)methanesulfonyl]-1H-indol-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | E588-0460 |
| Compound Name: | 1-(azepan-1-yl)-2-{3-[(4-bromophenyl)methanesulfonyl]-1H-indol-1-yl}ethan-1-one |
| Molecular Weight: | 489.43 |
| Molecular Formula: | C23 H25 Br N2 O3 S |
| Smiles: | C1CCCN(CC1)C(Cn1cc(c2ccccc12)S(Cc1ccc(cc1)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1651 |
| logD: | 4.1651 |
| logSw: | -4.0338 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.459 |
| InChI Key: | VWLKQPSCFDTICF-UHFFFAOYSA-N |