N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide
Chemical Structure Depiction of
N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide
N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide
Compound characteristics
| Compound ID: | C696-0988 |
| Compound Name: | N-[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-2-{1-oxo-4-[(pyridin-4-yl)methyl]phthalazin-2(1H)-yl}acetamide |
| Molecular Weight: | 455.45 |
| Molecular Formula: | C25 H18 F N5 O3 |
| Smiles: | C(C1c2ccccc2C(N(CC(Nc2cc(c3cccc(c3)F)no2)=O)N=1)=O)c1ccncc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1099 |
| logD: | 3.1058 |
| logSw: | -3.3271 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.957 |
| InChI Key: | XSOLLWSMPHCEHS-UHFFFAOYSA-N |