N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanamide
Compound characteristics
| Compound ID: | D144-1112 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanamide |
| Molecular Weight: | 395.41 |
| Molecular Formula: | C22 H21 N O6 |
| Smiles: | CC1=C(CCC(NCc2ccc3c(c2)OCO3)=O)C(=O)Oc2c1ccc(c2C)O |
| Stereo: | ACHIRAL |
| logP: | 3.1018 |
| logD: | 3.0973 |
| logSw: | -3.1971 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.708 |
| InChI Key: | HOTQRVYVYHZIGN-UHFFFAOYSA-N |