methyl 3-{[2-(4-nitrophenyl)imidazo[1,2-a]pyrazin-3-yl]amino}benzoate
Chemical Structure Depiction of
methyl 3-{[2-(4-nitrophenyl)imidazo[1,2-a]pyrazin-3-yl]amino}benzoate
methyl 3-{[2-(4-nitrophenyl)imidazo[1,2-a]pyrazin-3-yl]amino}benzoate
Compound characteristics
| Compound ID: | D401-0773 |
| Compound Name: | methyl 3-{[2-(4-nitrophenyl)imidazo[1,2-a]pyrazin-3-yl]amino}benzoate |
| Molecular Weight: | 389.37 |
| Molecular Formula: | C20 H15 N5 O4 |
| Smiles: | COC(c1cccc(c1)Nc1c(c2ccc(cc2)[N+]([O-])=O)nc2cnccn12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8216 |
| logD: | 3.8213 |
| logSw: | -3.9041 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.752 |
| InChI Key: | GQEPKXIGKKEVTD-UHFFFAOYSA-N |