3-({3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl}amino)-4-(pyrrolidin-1-yl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-({3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl}amino)-4-(pyrrolidin-1-yl)cyclobut-3-ene-1,2-dione
3-({3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl}amino)-4-(pyrrolidin-1-yl)cyclobut-3-ene-1,2-dione
Compound characteristics
Compound ID: | E144-0619 |
Compound Name: | 3-({3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl}amino)-4-(pyrrolidin-1-yl)cyclobut-3-ene-1,2-dione |
Molecular Weight: | 416.91 |
Molecular Formula: | C21 H25 Cl N4 O3 |
Smiles: | C1CCN(C1)C1=C(C(C1=O)=O)NCCC(N1CCN(CC1)c1cccc(c1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 1.9379 |
logD: | 1.9378 |
logSw: | -3.0056 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.719 |
InChI Key: | WABSEDPZIWGZRC-UHFFFAOYSA-N |