N-(2,6-dimethylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(2,6-dimethylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide
N-(2,6-dimethylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | D731-0749 |
| Compound Name: | N-(2,6-dimethylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide |
| Molecular Weight: | 295.34 |
| Molecular Formula: | C18 H17 N O3 |
| Smiles: | Cc1cccc(C)c1NC(C1Cc2ccccc2C(=O)O1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.163 |
| logD: | 3.1629 |
| logSw: | -3.3889 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.758 |
| InChI Key: | XBBTXGSTDONCAA-HNNXBMFYSA-N |