1-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-5-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]ethan-1-one
Chemical Structure Depiction of
1-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-5-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]ethan-1-one
1-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-5-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | G384-0010 |
| Compound Name: | 1-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-5-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]ethan-1-one |
| Molecular Weight: | 453.56 |
| Molecular Formula: | C24 H27 N3 O4 S |
| Smiles: | CC(N1C(Cc2cc(ccc12)S(N1CCCC1)(=O)=O)C(N1CCc2ccccc2C1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5584 |
| logD: | 2.5584 |
| logSw: | -2.9352 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.392 |
| InChI Key: | LWRWLFNSWMCAHQ-HSZRJFAPSA-N |