N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-oxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline-8-sulfonyl)propanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-oxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline-8-sulfonyl)propanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-oxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline-8-sulfonyl)propanamide
Compound characteristics
| Compound ID: | G114-0047 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-oxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline-8-sulfonyl)propanamide |
| Molecular Weight: | 472.56 |
| Molecular Formula: | C24 H28 N2 O6 S |
| Smiles: | COc1ccc(CCNC(CCS(c2cc3CCC(N4CCc(c2)c34)=O)(=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.2762 |
| logD: | 1.2762 |
| logSw: | -2.4514 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.18 |
| InChI Key: | HUPPALGQTJGHOT-UHFFFAOYSA-N |