N-[(2RS)-1-hydroxy-3-methylpentan-2-yl]-3-methyl-4-oxo-2-phenyl-4H-1-benzopyran-8-carboxamide
Chemical Structure Depiction of
N-[(2RS)-1-hydroxy-3-methylpentan-2-yl]-3-methyl-4-oxo-2-phenyl-4H-1-benzopyran-8-carboxamide
N-[(2RS)-1-hydroxy-3-methylpentan-2-yl]-3-methyl-4-oxo-2-phenyl-4H-1-benzopyran-8-carboxamide
Compound characteristics
| Compound ID: | Y042-9836 |
| Compound Name: | N-[(2RS)-1-hydroxy-3-methylpentan-2-yl]-3-methyl-4-oxo-2-phenyl-4H-1-benzopyran-8-carboxamide |
| Molecular Weight: | 379.45 |
| Molecular Formula: | C23 H25 N O4 |
| Smiles: | CC[C@@H](C)[C@@H](CO)NC(c1cccc2C(C(C)=C(c3ccccc3)Oc12)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2299 |
| logD: | 4.2299 |
| logSw: | -4.2485 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.392 |
| InChI Key: | LJWDERSGUITJBL-LIRRHRJNSA-N |