3-[({4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl}methyl)amino]-4-(4-methylpiperidin-1-yl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-[({4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl}methyl)amino]-4-(4-methylpiperidin-1-yl)cyclobut-3-ene-1,2-dione
3-[({4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl}methyl)amino]-4-(4-methylpiperidin-1-yl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | K906-2514 |
| Compound Name: | 3-[({4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl}methyl)amino]-4-(4-methylpiperidin-1-yl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 500.64 |
| Molecular Formula: | C30 H36 N4 O3 |
| Smiles: | CC1CCN(CC1)C1=C(C(C1=O)=O)NCc1ccc(cc1)C(N1CCN(CC1)c1cccc(C)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2561 |
| logD: | 4.2507 |
| logSw: | -4.1872 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.466 |
| InChI Key: | JCZNOEYBZITQAN-UHFFFAOYSA-N |