{4-[3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)piperidine-1-sulfonyl]-1H-pyrrol-2-yl}(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
{4-[3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)piperidine-1-sulfonyl]-1H-pyrrol-2-yl}(pyrrolidin-1-yl)methanone
{4-[3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)piperidine-1-sulfonyl]-1H-pyrrol-2-yl}(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | F899-0086 |
| Compound Name: | {4-[3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)piperidine-1-sulfonyl]-1H-pyrrol-2-yl}(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 470.59 |
| Molecular Formula: | C24 H30 N4 O4 S |
| Smiles: | C1CCN(C1)C(c1cc(c[nH]1)S(N1CCCC(C1)C(N1CCc2ccccc2C1)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2447 |
| logD: | 2.2447 |
| logSw: | -2.8431 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.363 |
| InChI Key: | WIEVMFDVIQVNKF-FQEVSTJZSA-N |