N-ethyl-N-(4-ethylphenyl)-2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}acetamide
Chemical Structure Depiction of
N-ethyl-N-(4-ethylphenyl)-2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}acetamide
N-ethyl-N-(4-ethylphenyl)-2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}acetamide
Compound characteristics
Compound ID: | C210-0128 |
Compound Name: | N-ethyl-N-(4-ethylphenyl)-2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}acetamide |
Molecular Weight: | 581.72 |
Molecular Formula: | C27 H31 N7 O4 S2 |
Smiles: | CCc1ccc(cc1)N(CC)C(CN1C=Nc2c(C1=O)c(c(C)s2)S(N1CCN(CC1)c1ncccn1)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.1106 |
logD: | 3.1106 |
logSw: | -3.276 |
Hydrogen bond acceptors count: | 12 |
Polar surface area: | 94.666 |
InChI Key: | BPIYAJWCIFTETP-UHFFFAOYSA-N |