methyl 3-{[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]amino}-3-oxopropanoate
Chemical Structure Depiction of
methyl 3-{[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]amino}-3-oxopropanoate
methyl 3-{[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]amino}-3-oxopropanoate
Compound characteristics
| Compound ID: | C301-5934 |
| Compound Name: | methyl 3-{[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]amino}-3-oxopropanoate |
| Molecular Weight: | 290.27 |
| Molecular Formula: | C14 H14 N2 O5 |
| Smiles: | CNC1=C(C(=O)Oc2ccccc12)NC(CC(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 0.0011 |
| logD: | -0.0419 |
| logSw: | -2.0868 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.943 |
| InChI Key: | QMAZEABILPXNTK-UHFFFAOYSA-N |