4-[3-(4-benzylpiperidine-1-sulfonyl)-4-methylphenyl]-2-methylphthalazin-1(2H)-one
Chemical Structure Depiction of
4-[3-(4-benzylpiperidine-1-sulfonyl)-4-methylphenyl]-2-methylphthalazin-1(2H)-one
4-[3-(4-benzylpiperidine-1-sulfonyl)-4-methylphenyl]-2-methylphthalazin-1(2H)-one
Compound characteristics
| Compound ID: | 6216-0138 |
| Compound Name: | 4-[3-(4-benzylpiperidine-1-sulfonyl)-4-methylphenyl]-2-methylphthalazin-1(2H)-one |
| Molecular Weight: | 487.62 |
| Molecular Formula: | C28 H29 N3 O3 S |
| Smiles: | Cc1ccc(cc1S(N1CCC(CC1)Cc1ccccc1)(=O)=O)C1c2ccccc2C(N(C)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3366 |
| logD: | 5.3365 |
| logSw: | -5.3632 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.585 |
| InChI Key: | VZKIRHWAZUHTKY-UHFFFAOYSA-N |