ethyl 4-[(6-nitro-2-oxo-2H-1-benzopyran-3-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(6-nitro-2-oxo-2H-1-benzopyran-3-carbonyl)amino]benzoate
ethyl 4-[(6-nitro-2-oxo-2H-1-benzopyran-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | 8015-0554 |
| Compound Name: | ethyl 4-[(6-nitro-2-oxo-2H-1-benzopyran-3-carbonyl)amino]benzoate |
| Molecular Weight: | 382.33 |
| Molecular Formula: | C19 H14 N2 O7 |
| Smiles: | CCOC(c1ccc(cc1)NC(C1=Cc2cc(ccc2OC1=O)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4442 |
| logD: | 3.3821 |
| logSw: | -3.8869 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.386 |
| InChI Key: | DFXYGQZJSLTJGV-UHFFFAOYSA-N |