2-{4-[4-methyl-3-(piperidine-1-sulfonyl)phenyl]-1-oxophthalazin-2(1H)-yl}-N-[(pyridin-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{4-[4-methyl-3-(piperidine-1-sulfonyl)phenyl]-1-oxophthalazin-2(1H)-yl}-N-[(pyridin-2-yl)methyl]acetamide
2-{4-[4-methyl-3-(piperidine-1-sulfonyl)phenyl]-1-oxophthalazin-2(1H)-yl}-N-[(pyridin-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | 8013-0458 |
| Compound Name: | 2-{4-[4-methyl-3-(piperidine-1-sulfonyl)phenyl]-1-oxophthalazin-2(1H)-yl}-N-[(pyridin-2-yl)methyl]acetamide |
| Molecular Weight: | 531.63 |
| Molecular Formula: | C28 H29 N5 O4 S |
| Smiles: | Cc1ccc(cc1S(N1CCCCC1)(=O)=O)C1c2ccccc2C(N(CC(NCc2ccccn2)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9875 |
| logD: | 2.9865 |
| logSw: | -3.4573 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.921 |
| InChI Key: | JZJMVLGQOUEXOM-UHFFFAOYSA-N |