N-(3-chloro-2-methylphenyl)-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-4-oxo-4H-1-benzopyran-2-carboxamide
N-(3-chloro-2-methylphenyl)-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D103-2235 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-4-oxo-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 313.74 |
| Molecular Formula: | C17 H12 Cl N O3 |
| Smiles: | [H]N(C(C1=CC(c2ccccc2O1)=O)=O)c1cccc(c1C)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.0958 |
| logD: | 4.0773 |
| logSw: | -4.3776 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.45 |
| InChI Key: | COYSUMDCDPEVHT-UHFFFAOYSA-N |