(4-bromophenyl)[1,2-di(propane-1-sulfonyl)pyrrolo[2,1-a]isoquinolin-3-yl]methanone
Chemical Structure Depiction of
(4-bromophenyl)[1,2-di(propane-1-sulfonyl)pyrrolo[2,1-a]isoquinolin-3-yl]methanone
(4-bromophenyl)[1,2-di(propane-1-sulfonyl)pyrrolo[2,1-a]isoquinolin-3-yl]methanone
Compound characteristics
| Compound ID: | 8009-9912 |
| Compound Name: | (4-bromophenyl)[1,2-di(propane-1-sulfonyl)pyrrolo[2,1-a]isoquinolin-3-yl]methanone |
| Molecular Weight: | 562.5 |
| Molecular Formula: | C25 H24 Br N O5 S2 |
| Smiles: | CCCS(c1c(c2c3ccccc3ccn2c1C(c1ccc(cc1)[Br])=O)S(CCC)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8028 |
| logD: | 4.8027 |
| logSw: | -5.2008 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 69.741 |
| InChI Key: | ROQNOZFJERTLRM-UHFFFAOYSA-N |