4-(3-{4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-1-benzopyran-3-yl}propanamido)benzamide
Chemical Structure Depiction of
4-(3-{4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-1-benzopyran-3-yl}propanamido)benzamide
4-(3-{4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-1-benzopyran-3-yl}propanamido)benzamide
Compound characteristics
| Compound ID: | Y042-3650 |
| Compound Name: | 4-(3-{4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-1-benzopyran-3-yl}propanamido)benzamide |
| Molecular Weight: | 420.46 |
| Molecular Formula: | C24 H24 N2 O5 |
| Smiles: | CC(=C)COc1ccc2C(C)=C(CCC(Nc3ccc(cc3)C(N)=O)=O)C(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 3.147 |
| logD: | 3.1449 |
| logSw: | -3.5893 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.596 |
| InChI Key: | KRFURJNDLZCTMH-UHFFFAOYSA-N |