RefChem:378210
2-[2-(diethylamino)ethylcarbamoyl]-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-3-carboxylic acid
Also Known As: 5-22-05-00599 (Beilstein Handbook Reference)|Pyrrolo(2,1-a)isoquinoline-3-carboxylic acid, 5,6-dihydro-2-((2-(diethylamino)ethyl)carbamoyl)-8,9-dimethoxy-|2-(2-diethylaminoethylcarbamoyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-3-carboxylic acid|2-[[[2-(Diethylamino)ethyl]amino]carbonyl]-5,6-dihydro-8,9-dimethoxypyrrolo[2,1-a]isoquinoline-3-carboxylic acid|2-{[2-(diethylamino)ethyl]carbamoyl}-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-3-carboxylic acid|2-{[2-(DIETHYLAMINO)ETHYL]CARBAMOYL}-8,9-DIMETHOXY-5H,6H-PYRROLO[2,1-A]ISOQUINOLINE-3-CARBOXYLIC ACID
| Molecular Formula | C22H29N3O5 |
|---|---|
| Molecular Weight | 415.21072 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 93.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 415.21072 |
| Monoisotopic Mass | 415.21072 |
| Heavy Atoms | 30 |
| Complexity | 599.0 |
Chemical Identifiers
| CAS Number | 17606-23-4 |
|---|---|
| SMILES | CCN(CC)CCNC(=O)C1=C(N2CCC3=CC(=C(C=C3C2=C1)OC)OC)C(=O)O |
| InChIKey | RDAQTRQJGTWCMP-UHFFFAOYSA-N |
Product Overview
RefChem:378210 (CAS 17606-23-4), with molecular formula C22H29N3O5 and molecular weight 415.21072 g/mol. IUPAC: 2-[2-(diethylamino)ethylcarbamoyl]-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-3-carboxylic acid.