methyl 1,2-di(propane-1-sulfonyl)pyrrolo[2,1-a]isoquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 1,2-di(propane-1-sulfonyl)pyrrolo[2,1-a]isoquinoline-3-carboxylate
methyl 1,2-di(propane-1-sulfonyl)pyrrolo[2,1-a]isoquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 8009-9942 |
| Compound Name: | methyl 1,2-di(propane-1-sulfonyl)pyrrolo[2,1-a]isoquinoline-3-carboxylate |
| Molecular Weight: | 437.53 |
| Molecular Formula: | C20 H23 N O6 S2 |
| Smiles: | CCCS(c1c(c2c3ccccc3ccn2c1C(=O)OC)S(CCC)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4295 |
| logD: | 2.4294 |
| logSw: | -2.6538 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 77.448 |
| InChI Key: | NSSUPTGHGVFDHT-UHFFFAOYSA-N |