ethyl 4-({2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3,4-dioxocyclobut-1-en-1-yl}amino)piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-({2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3,4-dioxocyclobut-1-en-1-yl}amino)piperidine-1-carboxylate
ethyl 4-({2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3,4-dioxocyclobut-1-en-1-yl}amino)piperidine-1-carboxylate
Compound characteristics
Compound ID: | C748-0104 |
Compound Name: | ethyl 4-({2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3,4-dioxocyclobut-1-en-1-yl}amino)piperidine-1-carboxylate |
Molecular Weight: | 440.54 |
Molecular Formula: | C24 H32 N4 O4 |
Smiles: | CCOC(N1CCC(CC1)NC1=C(C(C1=O)=O)N1CCN(CC1)c1cc(C)ccc1C)=O |
Stereo: | ACHIRAL |
logP: | 3.6824 |
logD: | 3.6796 |
logSw: | -3.7852 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.324 |
InChI Key: | WBENNZXRNFOIHO-UHFFFAOYSA-N |