ethyl (4-{[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}phenyl)acetate
Chemical Structure Depiction of
ethyl (4-{[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}phenyl)acetate
ethyl (4-{[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}phenyl)acetate
Compound characteristics
| Compound ID: | F129-0031 |
| Compound Name: | ethyl (4-{[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}phenyl)acetate |
| Molecular Weight: | 395.41 |
| Molecular Formula: | C21 H21 N3 O5 |
| Smiles: | CCOC(Cc1ccc(cc1)NC(NC1=C(c2ccccc2OC1=O)NC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5636 |
| logD: | 2.5565 |
| logSw: | -3.2725 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.676 |
| InChI Key: | AIVGNKQEHUKFIX-UHFFFAOYSA-N |