3-(2,5-dimethyl-1H-pyrrol-1-yl)-N-(4-oxo-4H-1-benzopyran-6-yl)propanamide
Chemical Structure Depiction of
3-(2,5-dimethyl-1H-pyrrol-1-yl)-N-(4-oxo-4H-1-benzopyran-6-yl)propanamide
3-(2,5-dimethyl-1H-pyrrol-1-yl)-N-(4-oxo-4H-1-benzopyran-6-yl)propanamide
Compound characteristics
| Compound ID: | IB09-4374 |
| Compound Name: | 3-(2,5-dimethyl-1H-pyrrol-1-yl)-N-(4-oxo-4H-1-benzopyran-6-yl)propanamide |
| Molecular Weight: | 310.35 |
| Molecular Formula: | C18 H18 N2 O3 |
| Smiles: | Cc1ccc(C)n1CCC(Nc1ccc2c(c1)C(C=CO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.62 |
| logD: | 2.62 |
| logSw: | -3.52 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.04 |
| InChI Key: | IFMPXTHWOUIURY-UHFFFAOYSA-N |