7-(diethylamino)-3-(hydroxymethyl)-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-(diethylamino)-3-(hydroxymethyl)-4-methyl-2H-1-benzopyran-2-one
7-(diethylamino)-3-(hydroxymethyl)-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 0083-0114 |
| Compound Name: | 7-(diethylamino)-3-(hydroxymethyl)-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 261.32 |
| Molecular Formula: | C15 H19 N O3 |
| Smiles: | CCN(CC)c1ccc2C(C)=C(CO)C(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 2.4741 |
| logD: | 2.4741 |
| logSw: | -2.882 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.012 |
| InChI Key: | XGPAGXKXJDKNMG-UHFFFAOYSA-N |