benzyl 2-amino-1-pentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Chemical Structure Depiction of
benzyl 2-amino-1-pentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
benzyl 2-amino-1-pentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Compound characteristics
| Compound ID: | IB09-5012 |
| Compound Name: | benzyl 2-amino-1-pentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate |
| Molecular Weight: | 388.47 |
| Molecular Formula: | C23 H24 N4 O2 |
| Smiles: | CCCCCn1c(c(C(=O)OCc2ccccc2)c2c1nc1ccccc1n2)N |
| Stereo: | ACHIRAL |
| logP: | 5.15 |
| logD: | 5.15 |
| logSw: | -5.57 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.56 |
| InChI Key: | LDUDNIPFTINHAF-UHFFFAOYSA-N |