3-[({4-[4-(3-chlorophenyl)piperazine-1-carbonyl]cyclohexyl}methyl)amino]-4-(pyrrolidin-1-yl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-[({4-[4-(3-chlorophenyl)piperazine-1-carbonyl]cyclohexyl}methyl)amino]-4-(pyrrolidin-1-yl)cyclobut-3-ene-1,2-dione
3-[({4-[4-(3-chlorophenyl)piperazine-1-carbonyl]cyclohexyl}methyl)amino]-4-(pyrrolidin-1-yl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | K906-3536 |
| Compound Name: | 3-[({4-[4-(3-chlorophenyl)piperazine-1-carbonyl]cyclohexyl}methyl)amino]-4-(pyrrolidin-1-yl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 485.03 |
| Molecular Formula: | C26 H33 Cl N4 O3 |
| Smiles: | C1CCN(C1)C1=C(C(C1=O)=O)NCC1CCC(CC1)C(N1CCN(CC1)c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1059 |
| logD: | 4.1055 |
| logSw: | -4.4023 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.326 |
| InChI Key: | MZEXFLNGHXSYBI-UHFFFAOYSA-N |