2-[1-(5-bromothiophene-2-sulfonyl)piperidin-4-yl]-N-[(pyridin-4-yl)methyl]acetamide
Chemical Structure Depiction of
2-[1-(5-bromothiophene-2-sulfonyl)piperidin-4-yl]-N-[(pyridin-4-yl)methyl]acetamide
2-[1-(5-bromothiophene-2-sulfonyl)piperidin-4-yl]-N-[(pyridin-4-yl)methyl]acetamide
Compound characteristics
Compound ID: | L629-1182 |
Compound Name: | 2-[1-(5-bromothiophene-2-sulfonyl)piperidin-4-yl]-N-[(pyridin-4-yl)methyl]acetamide |
Molecular Weight: | 458.39 |
Molecular Formula: | C17 H20 Br N3 O3 S2 |
Smiles: | [H]C(C1CCN(CC1)S(c1ccc(s1)[Br])(=O)=O)C(NCc1ccncc1)=O |
Stereo: | ACHIRAL |
logP: | 2.3291 |
logD: | 2.3258 |
logSw: | -2.5985 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.596 |
InChI Key: | ITZHLHYMJADSSH-UHFFFAOYSA-N |