methyl 2-{[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}benzoate
Chemical Structure Depiction of
methyl 2-{[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}benzoate
methyl 2-{[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}benzoate
Compound characteristics
| Compound ID: | F129-0008 |
| Compound Name: | methyl 2-{[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}benzoate |
| Molecular Weight: | 367.36 |
| Molecular Formula: | C19 H17 N3 O5 |
| Smiles: | CNC1=C(C(=O)Oc2ccccc12)NC(Nc1ccccc1C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2339 |
| logD: | 2.2239 |
| logSw: | -2.9783 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.994 |
| InChI Key: | PGGFUFJAFFBFSW-UHFFFAOYSA-N |