6-[4-(5-bromofuran-2-carbonyl)piperazine-1-sulfonyl]-3-ethyl-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(5-bromofuran-2-carbonyl)piperazine-1-sulfonyl]-3-ethyl-1,3-benzothiazol-2(3H)-one
6-[4-(5-bromofuran-2-carbonyl)piperazine-1-sulfonyl]-3-ethyl-1,3-benzothiazol-2(3H)-one
Compound characteristics
Compound ID: | L475-0342 |
Compound Name: | 6-[4-(5-bromofuran-2-carbonyl)piperazine-1-sulfonyl]-3-ethyl-1,3-benzothiazol-2(3H)-one |
Molecular Weight: | 500.39 |
Molecular Formula: | C18 H18 Br N3 O5 S2 |
Smiles: | CCN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)C(c1ccc(o1)[Br])=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.2418 |
logD: | 3.2418 |
logSw: | -3.677 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 72.901 |
InChI Key: | NRKBYPCIFTUKHQ-UHFFFAOYSA-N |