N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-[4-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)phenyl]acetamide
Chemical Structure Depiction of
N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-[4-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)phenyl]acetamide
N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-[4-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)phenyl]acetamide
Compound characteristics
Compound ID: | C172-0004 |
Compound Name: | N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-[4-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)phenyl]acetamide |
Molecular Weight: | 538.07 |
Molecular Formula: | C27 H28 Cl N5 O3 S |
Smiles: | C(CNC(Cc1ccc(cc1)N1C(c2c(ccs2)NC1=O)=O)=O)CN1CCN(CC1)c1cccc(c1)[Cl] |
Stereo: | ACHIRAL |
logP: | 2.8742 |
logD: | 2.2881 |
logSw: | -3.5489 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.172 |
InChI Key: | MDNQTFHGWUHILK-UHFFFAOYSA-N |