heptyl 2-amino-1-(4-chlorophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Chemical Structure Depiction of
heptyl 2-amino-1-(4-chlorophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
heptyl 2-amino-1-(4-chlorophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Compound characteristics
| Compound ID: | IB04-0609 |
| Compound Name: | heptyl 2-amino-1-(4-chlorophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate |
| Molecular Weight: | 436.94 |
| Molecular Formula: | C24 H25 Cl N4 O2 |
| Smiles: | CCCCCCCOC(c1c2c(nc3ccccc3n2)n(c2ccc(cc2)[Cl])c1N)=O |
| Stereo: | ACHIRAL |
| logP: | 6.63 |
| logD: | 6.63 |
| logSw: | -6.62 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 108.56 |
| InChI Key: | KERASXBMVQIOAU-UHFFFAOYSA-N |