N-(3-methyl-4-{4-methyl-3-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]phenyl}-1,2-oxazol-5-yl)acetamide
Chemical Structure Depiction of
N-(3-methyl-4-{4-methyl-3-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]phenyl}-1,2-oxazol-5-yl)acetamide
N-(3-methyl-4-{4-methyl-3-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]phenyl}-1,2-oxazol-5-yl)acetamide
Compound characteristics
Compound ID: | M018-0166 |
Compound Name: | N-(3-methyl-4-{4-methyl-3-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]phenyl}-1,2-oxazol-5-yl)acetamide |
Molecular Weight: | 456.52 |
Molecular Formula: | C21 H24 N6 O4 S |
Smiles: | CC(Nc1c(c2ccc(C)c(c2)S(N2CCN(CC2)c2ncccn2)(=O)=O)c(C)no1)=O |
Stereo: | ACHIRAL |
logP: | 2.1142 |
logD: | 2.0922 |
logSw: | -2.9154 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 99.227 |
InChI Key: | BHQPANLJFBCSPJ-UHFFFAOYSA-N |