ethyl 4-[4-amino-5-(4-chlorobenzene-1-sulfonyl)pyrimidin-2-yl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[4-amino-5-(4-chlorobenzene-1-sulfonyl)pyrimidin-2-yl]piperazine-1-carboxylate
ethyl 4-[4-amino-5-(4-chlorobenzene-1-sulfonyl)pyrimidin-2-yl]piperazine-1-carboxylate
Compound characteristics
Compound ID: | M184-0203 |
Compound Name: | ethyl 4-[4-amino-5-(4-chlorobenzene-1-sulfonyl)pyrimidin-2-yl]piperazine-1-carboxylate |
Molecular Weight: | 425.89 |
Molecular Formula: | C17 H20 Cl N5 O4 S |
Smiles: | CCOC(N1CCN(CC1)c1ncc(c(N)n1)S(c1ccc(cc1)[Cl])(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.2637 |
logD: | 2.2637 |
logSw: | -2.8773 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 94.688 |
InChI Key: | YKSLLQTUZXLPCM-UHFFFAOYSA-N |