methyl 2-{[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}benzoate
Chemical Structure Depiction of
methyl 2-{[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}benzoate
methyl 2-{[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}benzoate
Compound characteristics
| Compound ID: | F129-0075 |
| Compound Name: | methyl 2-{[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}benzoate |
| Molecular Weight: | 381.39 |
| Molecular Formula: | C20 H19 N3 O5 |
| Smiles: | CCNC1=C(C(=O)Oc2ccccc12)NC(Nc1ccccc1C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5964 |
| logD: | 2.5869 |
| logSw: | -3.332 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.469 |
| InChI Key: | IYECYPCVJIQYJP-UHFFFAOYSA-N |