(4-chlorophenyl)[1,2-di(ethanesulfonyl)pyrrolo[2,1-a]isoquinolin-3-yl]methanone
Chemical Structure Depiction of
(4-chlorophenyl)[1,2-di(ethanesulfonyl)pyrrolo[2,1-a]isoquinolin-3-yl]methanone
(4-chlorophenyl)[1,2-di(ethanesulfonyl)pyrrolo[2,1-a]isoquinolin-3-yl]methanone
Compound characteristics
| Compound ID: | 8002-4132 |
| Compound Name: | (4-chlorophenyl)[1,2-di(ethanesulfonyl)pyrrolo[2,1-a]isoquinolin-3-yl]methanone |
| Molecular Weight: | 490 |
| Molecular Formula: | C23 H20 Cl N O5 S2 |
| Smiles: | CCS(c1c(c2c3ccccc3ccn2c1C(c1ccc(cc1)[Cl])=O)S(CC)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6541 |
| logD: | 3.6541 |
| logSw: | -4.0802 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 69.741 |
| InChI Key: | KISRKQXJFCCYNF-UHFFFAOYSA-N |