4-{[2-(7-methoxy-8-methyl-2-oxo-2H-1-benzopyran-4-yl)acetamido]methyl}cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
4-{[2-(7-methoxy-8-methyl-2-oxo-2H-1-benzopyran-4-yl)acetamido]methyl}cyclohexane-1-carboxylic acid
4-{[2-(7-methoxy-8-methyl-2-oxo-2H-1-benzopyran-4-yl)acetamido]methyl}cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | Y041-2403 |
| Compound Name: | 4-{[2-(7-methoxy-8-methyl-2-oxo-2H-1-benzopyran-4-yl)acetamido]methyl}cyclohexane-1-carboxylic acid |
| Molecular Weight: | 387.43 |
| Molecular Formula: | C21 H25 N O6 |
| Smiles: | Cc1c(ccc2C(CC(NC[C@@H]3CC[C@H](CC3)C(O)=O)=O)=CC(=O)Oc12)OC |
| Stereo: | ACHIRAL |
| logP: | 2.0013 |
| logD: | -0.5591 |
| logSw: | -2.7014 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.761 |
| InChI Key: | QBTUAXVTKIGPIW-UHFFFAOYSA-N |