N-(3-chloro-4-methylphenyl)-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide
N-(3-chloro-4-methylphenyl)-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | D731-0671 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide |
| Molecular Weight: | 329.78 |
| Molecular Formula: | C18 H16 Cl N O3 |
| Smiles: | Cc1ccc(cc1[Cl])NC(C1(C)Cc2ccccc2C(=O)O1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7321 |
| logD: | 4.7306 |
| logSw: | -4.836 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.451 |
| InChI Key: | NCBNSQWUFGCHNP-SFHVURJKSA-N |