4-[3-(4-benzylpiperidine-1-sulfonyl)-4-methylphenyl]phthalazin-1(2H)-one
Chemical Structure Depiction of
4-[3-(4-benzylpiperidine-1-sulfonyl)-4-methylphenyl]phthalazin-1(2H)-one
4-[3-(4-benzylpiperidine-1-sulfonyl)-4-methylphenyl]phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | 6216-0149 |
| Compound Name: | 4-[3-(4-benzylpiperidine-1-sulfonyl)-4-methylphenyl]phthalazin-1(2H)-one |
| Molecular Weight: | 473.59 |
| Molecular Formula: | C27 H27 N3 O3 S |
| Smiles: | Cc1ccc(cc1S(N1CCC(CC1)Cc1ccccc1)(=O)=O)C1c2ccccc2C(NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3374 |
| logD: | 5.3369 |
| logSw: | -5.3805 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.797 |
| InChI Key: | BLZWKBHAJQHZBP-UHFFFAOYSA-N |