4-[3-(4-acetylpiperazine-1-carbonyl)anilino]-5-(2,3-dimethylphenoxy)-2-methylpyridazin-3(2H)-one
Chemical Structure Depiction of
4-[3-(4-acetylpiperazine-1-carbonyl)anilino]-5-(2,3-dimethylphenoxy)-2-methylpyridazin-3(2H)-one
4-[3-(4-acetylpiperazine-1-carbonyl)anilino]-5-(2,3-dimethylphenoxy)-2-methylpyridazin-3(2H)-one
Compound characteristics
| Compound ID: | V016-4842 |
| Compound Name: | 4-[3-(4-acetylpiperazine-1-carbonyl)anilino]-5-(2,3-dimethylphenoxy)-2-methylpyridazin-3(2H)-one |
| Molecular Weight: | 475.55 |
| Molecular Formula: | C26 H29 N5 O4 |
| Smiles: | CC(N1CCN(CC1)C(c1cccc(c1)NC1=C(C=NN(C)C1=O)Oc1cccc(C)c1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3936 |
| logD: | 2.3922 |
| logSw: | -2.8071 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.617 |
| InChI Key: | CLMVVKBCKKVEAG-UHFFFAOYSA-N |