methyl 3-{[2-(5-bromo-2-hydroxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino}benzoate
Chemical Structure Depiction of
methyl 3-{[2-(5-bromo-2-hydroxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino}benzoate
methyl 3-{[2-(5-bromo-2-hydroxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino}benzoate
Compound characteristics
| Compound ID: | D401-0775 |
| Compound Name: | methyl 3-{[2-(5-bromo-2-hydroxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino}benzoate |
| Molecular Weight: | 439.27 |
| Molecular Formula: | C20 H15 Br N4 O3 |
| Smiles: | COC(c1cccc(c1)Nc1c(c2cc(ccc2O)[Br])nc2cnccn12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0541 |
| logD: | 5.0343 |
| logSw: | -4.2107 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.919 |
| InChI Key: | KOTAZZBXXLDADW-UHFFFAOYSA-N |