methyl 4-[3-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2(1H)-yl)propanamido]benzoate
Chemical Structure Depiction of
methyl 4-[3-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2(1H)-yl)propanamido]benzoate
methyl 4-[3-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2(1H)-yl)propanamido]benzoate
Compound characteristics
| Compound ID: | S372-0586 |
| Compound Name: | methyl 4-[3-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2(1H)-yl)propanamido]benzoate |
| Molecular Weight: | 394.43 |
| Molecular Formula: | C21 H22 N4 O4 |
| Smiles: | COC(c1ccc(cc1)NC(CCN1C=Cn2c(C1=O)c1CCCCc1n2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7679 |
| logD: | 1.7675 |
| logSw: | -2.1597 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.741 |
| InChI Key: | VOTGBUGPWHANQA-UHFFFAOYSA-N |