3-(4-chlorophenyl)-N-(2-methoxy-4-nitrophenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carboxamide
Chemical Structure Depiction of
3-(4-chlorophenyl)-N-(2-methoxy-4-nitrophenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carboxamide
3-(4-chlorophenyl)-N-(2-methoxy-4-nitrophenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carboxamide
Compound characteristics
| Compound ID: | D429-0284 |
| Compound Name: | 3-(4-chlorophenyl)-N-(2-methoxy-4-nitrophenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carboxamide |
| Molecular Weight: | 452.85 |
| Molecular Formula: | C23 H17 Cl N2 O6 |
| Smiles: | COc1cc(ccc1NC(c1ccc2C(=O)OC(Cc2c1)c1ccc(cc1)[Cl])=O)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1798 |
| logD: | 3.9168 |
| logSw: | -5.6107 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.196 |
| InChI Key: | PQWLOXJMHDGCQY-FQEVSTJZSA-N |