7-hydroxy-4-(4-methoxyphenyl)-8-[(pyrrolidin-1-yl)methyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-hydroxy-4-(4-methoxyphenyl)-8-[(pyrrolidin-1-yl)methyl]-2H-1-benzopyran-2-one
7-hydroxy-4-(4-methoxyphenyl)-8-[(pyrrolidin-1-yl)methyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D635-0152 |
| Compound Name: | 7-hydroxy-4-(4-methoxyphenyl)-8-[(pyrrolidin-1-yl)methyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 351.4 |
| Molecular Formula: | C21 H21 N O4 |
| Smiles: | COc1ccc(cc1)C1=CC(=O)Oc2c1ccc(c2CN1CCCC1)O |
| Stereo: | ACHIRAL |
| logP: | 3.2952 |
| logD: | 2.7539 |
| logSw: | -3.373 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.249 |
| InChI Key: | RMFSTFZQJFZOIL-UHFFFAOYSA-N |