1-[(7-hydroxy-2-oxo-2H-1-benzopyran-4-yl)acetyl]-4-phenylpiperidine-4-carboxylic acid
Chemical Structure Depiction of
1-[(7-hydroxy-2-oxo-2H-1-benzopyran-4-yl)acetyl]-4-phenylpiperidine-4-carboxylic acid
1-[(7-hydroxy-2-oxo-2H-1-benzopyran-4-yl)acetyl]-4-phenylpiperidine-4-carboxylic acid
Compound characteristics
| Compound ID: | Y040-3994 |
| Compound Name: | 1-[(7-hydroxy-2-oxo-2H-1-benzopyran-4-yl)acetyl]-4-phenylpiperidine-4-carboxylic acid |
| Molecular Weight: | 407.42 |
| Molecular Formula: | C23 H21 N O6 |
| Smiles: | C(C1=CC(=O)Oc2cc(ccc12)O)C(N1CCC(CC1)(C(O)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6134 |
| logD: | -0.9278 |
| logSw: | -2.5164 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.52 |
| InChI Key: | NMFVSVXUFAFWOZ-UHFFFAOYSA-N |