5-hydroxy-7-methyl-4-phenyl-6-[(pyrrolidin-1-yl)methyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
5-hydroxy-7-methyl-4-phenyl-6-[(pyrrolidin-1-yl)methyl]-2H-1-benzopyran-2-one
5-hydroxy-7-methyl-4-phenyl-6-[(pyrrolidin-1-yl)methyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-5623 |
| Compound Name: | 5-hydroxy-7-methyl-4-phenyl-6-[(pyrrolidin-1-yl)methyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 335.4 |
| Molecular Formula: | C21 H21 N O3 |
| Smiles: | Cc1cc2c(C(=CC(=O)O2)c2ccccc2)c(c1CN1CCCC1)O |
| Stereo: | ACHIRAL |
| logP: | 3.8284 |
| logD: | 3.0523 |
| logSw: | -4.3212 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.952 |
| InChI Key: | XOHXOILMMLLTCH-UHFFFAOYSA-N |