N-(4-chlorophenyl)-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide
N-(4-chlorophenyl)-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | D001-0030 |
| Compound Name: | N-(4-chlorophenyl)-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide |
| Molecular Weight: | 315.75 |
| Molecular Formula: | C17 H14 Cl N O3 |
| Smiles: | CC1(Cc2ccccc2C(=O)O1)C(Nc1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9366 |
| logD: | 3.9357 |
| logSw: | -4.54 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.451 |
| InChI Key: | SDZATQGETSTEFC-KRWDZBQOSA-N |