2-[3-(azepan-1-yl)-3-oxopropyl]-3-[1-(benzenesulfonyl)-1H-indol-3-yl]-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
2-[3-(azepan-1-yl)-3-oxopropyl]-3-[1-(benzenesulfonyl)-1H-indol-3-yl]-2,3-dihydro-1H-isoindol-1-one
2-[3-(azepan-1-yl)-3-oxopropyl]-3-[1-(benzenesulfonyl)-1H-indol-3-yl]-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | S322-0130 |
| Compound Name: | 2-[3-(azepan-1-yl)-3-oxopropyl]-3-[1-(benzenesulfonyl)-1H-indol-3-yl]-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 541.67 |
| Molecular Formula: | C31 H31 N3 O4 S |
| Smiles: | C1CCCN(CC1)C(CCN1C(c2ccccc2C1=O)c1cn(c2ccccc12)S(c1ccccc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8839 |
| logD: | 4.8839 |
| logSw: | -4.7537 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.712 |
| InChI Key: | KFUGALKJSOVPJJ-SSEXGKCCSA-N |