methyl 4-(2-{3-[acetyl(methyl)amino]-2-oxoquinoxalin-1(2H)-yl}acetamido)benzoate
Chemical Structure Depiction of
methyl 4-(2-{3-[acetyl(methyl)amino]-2-oxoquinoxalin-1(2H)-yl}acetamido)benzoate
methyl 4-(2-{3-[acetyl(methyl)amino]-2-oxoquinoxalin-1(2H)-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | J056-0032 |
| Compound Name: | methyl 4-(2-{3-[acetyl(methyl)amino]-2-oxoquinoxalin-1(2H)-yl}acetamido)benzoate |
| Molecular Weight: | 408.41 |
| Molecular Formula: | C21 H20 N4 O5 |
| Smiles: | CC(N(C)C1C(N(CC(Nc2ccc(cc2)C(=O)OC)=O)c2ccccc2N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4649 |
| logD: | 1.4648 |
| logSw: | -2.1595 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.199 |
| InChI Key: | ROLOJQVHRMLRHI-UHFFFAOYSA-N |