4-(3,5-dimethylpiperidine-1-carbonyl)-2-(4-methoxyphenyl)phthalazin-1(2H)-one
Chemical Structure Depiction of
4-(3,5-dimethylpiperidine-1-carbonyl)-2-(4-methoxyphenyl)phthalazin-1(2H)-one
4-(3,5-dimethylpiperidine-1-carbonyl)-2-(4-methoxyphenyl)phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | K999-0097 |
| Compound Name: | 4-(3,5-dimethylpiperidine-1-carbonyl)-2-(4-methoxyphenyl)phthalazin-1(2H)-one |
| Molecular Weight: | 391.47 |
| Molecular Formula: | C23 H25 N3 O3 |
| Smiles: | CC1CC(C)CN(C1)C(C1c2ccccc2C(N(c2ccc(cc2)OC)N=1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8012 |
| logD: | 3.8012 |
| logSw: | -4.0285 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.107 |
| InChI Key: | LBTHNELOFONULS-UHFFFAOYSA-N |