3-[({4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]cyclohexyl}methyl)amino]-4-(pyrrolidin-1-yl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-[({4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]cyclohexyl}methyl)amino]-4-(pyrrolidin-1-yl)cyclobut-3-ene-1,2-dione
3-[({4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]cyclohexyl}methyl)amino]-4-(pyrrolidin-1-yl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | K906-3534 |
| Compound Name: | 3-[({4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]cyclohexyl}methyl)amino]-4-(pyrrolidin-1-yl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 480.61 |
| Molecular Formula: | C27 H36 N4 O4 |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)C(C1CCC(CC1)CNC1=C(C(C1=O)=O)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6262 |
| logD: | 3.6257 |
| logSw: | -3.8237 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.869 |
| InChI Key: | YDZVZGIVOAPBID-UHFFFAOYSA-N |