6-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-4-phenyl-7-[(propan-2-yl)oxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-4-phenyl-7-[(propan-2-yl)oxy]-2H-1-benzopyran-2-one
6-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-4-phenyl-7-[(propan-2-yl)oxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-5405 |
| Compound Name: | 6-{3-oxo-3-[4-(pyridin-2-yl)piperazin-1-yl]propyl}-4-phenyl-7-[(propan-2-yl)oxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 497.59 |
| Molecular Formula: | C30 H31 N3 O4 |
| Smiles: | CC(C)Oc1cc2c(cc1CCC(N1CCN(CC1)c1ccccn1)=O)C(=CC(=O)O2)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9391 |
| logD: | 4.9303 |
| logSw: | -4.5921 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.156 |
| InChI Key: | XQZKRQBYLAXNFX-UHFFFAOYSA-N |