ethyl 4-[4-amino-5-(4-ethylbenzene-1-sulfonyl)pyrimidin-2-yl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[4-amino-5-(4-ethylbenzene-1-sulfonyl)pyrimidin-2-yl]piperazine-1-carboxylate
ethyl 4-[4-amino-5-(4-ethylbenzene-1-sulfonyl)pyrimidin-2-yl]piperazine-1-carboxylate
Compound characteristics
Compound ID: | M184-0700 |
Compound Name: | ethyl 4-[4-amino-5-(4-ethylbenzene-1-sulfonyl)pyrimidin-2-yl]piperazine-1-carboxylate |
Molecular Weight: | 419.5 |
Molecular Formula: | C19 H25 N5 O4 S |
Smiles: | CCc1ccc(cc1)S(c1cnc(nc1N)N1CCN(CC1)C(=O)OCC)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.5996 |
logD: | 2.5996 |
logSw: | -2.7622 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 94.688 |
InChI Key: | HWUYBSPUYGDYCN-UHFFFAOYSA-N |