6-[4-(3-cyclopentylpropanoyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(3-cyclopentylpropanoyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
6-[4-(3-cyclopentylpropanoyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Compound characteristics
Compound ID: | L475-0051 |
Compound Name: | 6-[4-(3-cyclopentylpropanoyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one |
Molecular Weight: | 423.55 |
Molecular Formula: | C19 H25 N3 O4 S2 |
Smiles: | C1CCC(C1)CCC(N1CCN(CC1)S(c1ccc2c(c1)SC(N2)=O)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.873 |
logD: | 2.8514 |
logSw: | -3.5483 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.584 |
InChI Key: | QTTBKOFQFCJPDT-UHFFFAOYSA-N |