4-[1-(4-ethylbenzene-1-sulfonyl)piperidin-3-yl]-5-(methoxymethyl)-2-methylpyrimidine
Chemical Structure Depiction of
4-[1-(4-ethylbenzene-1-sulfonyl)piperidin-3-yl]-5-(methoxymethyl)-2-methylpyrimidine
4-[1-(4-ethylbenzene-1-sulfonyl)piperidin-3-yl]-5-(methoxymethyl)-2-methylpyrimidine
Compound characteristics
Compound ID: | SA04-0182 |
Compound Name: | 4-[1-(4-ethylbenzene-1-sulfonyl)piperidin-3-yl]-5-(methoxymethyl)-2-methylpyrimidine |
Molecular Weight: | 389.52 |
Molecular Formula: | C20 H27 N3 O3 S |
Smiles: | CCc1ccc(cc1)S(N1CCCC(C1)c1c(COC)cnc(C)n1)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.3627 |
logD: | 3.3627 |
logSw: | -3.2341 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 59.511 |
InChI Key: | ZTSJLHRKZAFHAR-KRWDZBQOSA-N |