6-({5-[4-(2-fluorophenyl)piperazine-1-sulfonyl]thiophen-2-yl}methyl)-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
Chemical Structure Depiction of
6-({5-[4-(2-fluorophenyl)piperazine-1-sulfonyl]thiophen-2-yl}methyl)-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
6-({5-[4-(2-fluorophenyl)piperazine-1-sulfonyl]thiophen-2-yl}methyl)-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
Compound characteristics
Compound ID: | E786-2016 |
Compound Name: | 6-({5-[4-(2-fluorophenyl)piperazine-1-sulfonyl]thiophen-2-yl}methyl)-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione |
Molecular Weight: | 486.54 |
Molecular Formula: | C22 H19 F N4 O4 S2 |
Smiles: | C1CN(CCN1c1ccccc1F)S(c1ccc(CN2C(c3cccnc3C2=O)=O)s1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.1336 |
logD: | 2.1336 |
logSw: | -2.943 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 75.089 |
InChI Key: | MRGSIQDBZVBPCH-UHFFFAOYSA-N |