ethyl 3-(4-methoxyphenyl)-3-[(6-nitro-2-oxo-2H-1-benzopyran-3-carbonyl)amino]propanoate
Chemical Structure Depiction of
ethyl 3-(4-methoxyphenyl)-3-[(6-nitro-2-oxo-2H-1-benzopyran-3-carbonyl)amino]propanoate
ethyl 3-(4-methoxyphenyl)-3-[(6-nitro-2-oxo-2H-1-benzopyran-3-carbonyl)amino]propanoate
Compound characteristics
| Compound ID: | 8013-3841 |
| Compound Name: | ethyl 3-(4-methoxyphenyl)-3-[(6-nitro-2-oxo-2H-1-benzopyran-3-carbonyl)amino]propanoate |
| Molecular Weight: | 440.41 |
| Molecular Formula: | C22 H20 N2 O8 |
| Smiles: | CCOC(CC(c1ccc(cc1)OC)NC(C1=Cc2cc(ccc2OC1=O)[N+]([O-])=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2544 |
| logD: | 3.2543 |
| logSw: | -3.6121 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 106.288 |
| InChI Key: | VTRIRDIDYSZUHV-SFHVURJKSA-N |