2-[(6-{[(2-chlorophenyl)methyl]amino}pyrimidin-4-yl)sulfanyl]-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[(6-{[(2-chlorophenyl)methyl]amino}pyrimidin-4-yl)sulfanyl]-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethan-1-one
2-[(6-{[(2-chlorophenyl)methyl]amino}pyrimidin-4-yl)sulfanyl]-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethan-1-one
Compound characteristics
Compound ID: | M179-3601 |
Compound Name: | 2-[(6-{[(2-chlorophenyl)methyl]amino}pyrimidin-4-yl)sulfanyl]-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethan-1-one |
Molecular Weight: | 484.02 |
Molecular Formula: | C24 H26 Cl N5 O2 S |
Smiles: | COc1ccccc1N1CCN(CC1)C(CSc1cc(NCc2ccccc2[Cl])ncn1)=O |
Stereo: | ACHIRAL |
logP: | 4.3274 |
logD: | 4.3258 |
logSw: | -4.4009 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.922 |
InChI Key: | DFXBCIJYXZGTJF-UHFFFAOYSA-N |