2-[4-(2-chloro-5-fluorobenzoyl)piperazin-1-yl]-N-[(thiophen-2-yl)methyl]pyridine-3-carboxamide
Chemical Structure Depiction of
2-[4-(2-chloro-5-fluorobenzoyl)piperazin-1-yl]-N-[(thiophen-2-yl)methyl]pyridine-3-carboxamide
2-[4-(2-chloro-5-fluorobenzoyl)piperazin-1-yl]-N-[(thiophen-2-yl)methyl]pyridine-3-carboxamide
Compound characteristics
Compound ID: | V019-5958 |
Compound Name: | 2-[4-(2-chloro-5-fluorobenzoyl)piperazin-1-yl]-N-[(thiophen-2-yl)methyl]pyridine-3-carboxamide |
Molecular Weight: | 458.94 |
Molecular Formula: | C22 H20 Cl F N4 O2 S |
Smiles: | [H]C1([H])CN(CC([H])([H])N1C(c1cc(ccc1[Cl])F)=O)c1c(cccn1)C(NCc1cccs1)=O |
Stereo: | ACHIRAL |
logP: | 4.0546 |
logD: | 4.0542 |
logSw: | -4.4641 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.56 |
InChI Key: | IUEDSAAQFHOTMC-UHFFFAOYSA-N |