N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-3-methyl-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-3-methyl-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-3-methyl-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Compound characteristics
Compound ID: | C883-0525 |
Compound Name: | N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-3-methyl-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide |
Molecular Weight: | 486.59 |
Molecular Formula: | C28 H31 F N6 O |
Smiles: | Cc1c(C(NCCCN2CCN(CC2)c2ccc(cc2)F)=O)c(n2cccc2)n(c2ccccc2)n1 |
Stereo: | ACHIRAL |
logP: | 3.7637 |
logD: | 3.2198 |
logSw: | -4.0468 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.946 |
InChI Key: | BEKXFLQEFDEQOZ-UHFFFAOYSA-N |