3-{3-[4-(diethylamino)phenyl]prop-2-enoyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-{3-[4-(diethylamino)phenyl]prop-2-enoyl}-2H-1-benzopyran-2-one
3-{3-[4-(diethylamino)phenyl]prop-2-enoyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K229-1003 |
| Compound Name: | 3-{3-[4-(diethylamino)phenyl]prop-2-enoyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 347.41 |
| Molecular Formula: | C22 H21 N O3 |
| Smiles: | CCN(CC)c1ccc(/C=C/C(C2=Cc3ccccc3OC2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.441 |
| logD: | 4.4393 |
| logSw: | -4.5417 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.872 |
| InChI Key: | WHBQXAOYJYWNSN-UHFFFAOYSA-N |