ethyl (4-{[4-(benzylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}phenyl)acetate
Chemical Structure Depiction of
ethyl (4-{[4-(benzylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}phenyl)acetate
ethyl (4-{[4-(benzylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}phenyl)acetate
Compound characteristics
| Compound ID: | F129-0462 |
| Compound Name: | ethyl (4-{[4-(benzylamino)-2-oxo-2H-1-benzopyran-3-yl]carbamamido}phenyl)acetate |
| Molecular Weight: | 471.51 |
| Molecular Formula: | C27 H25 N3 O5 |
| Smiles: | CCOC(Cc1ccc(cc1)NC(NC1=C(c2ccccc2OC1=O)NCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.97 |
| logD: | 3.495 |
| logSw: | -4.3315 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.254 |
| InChI Key: | HIMXKEQOVXRAHW-UHFFFAOYSA-N |