6-[4-(2-methoxybenzoyl)piperazine-1-sulfonyl]-3-methyl-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(2-methoxybenzoyl)piperazine-1-sulfonyl]-3-methyl-1,3-benzothiazol-2(3H)-one
6-[4-(2-methoxybenzoyl)piperazine-1-sulfonyl]-3-methyl-1,3-benzothiazol-2(3H)-one
Compound characteristics
Compound ID: | L475-0243 |
Compound Name: | 6-[4-(2-methoxybenzoyl)piperazine-1-sulfonyl]-3-methyl-1,3-benzothiazol-2(3H)-one |
Molecular Weight: | 447.53 |
Molecular Formula: | C20 H21 N3 O5 S2 |
Smiles: | CN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)C(c1ccccc1OC)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.4348 |
logD: | 2.4348 |
logSw: | -3.0009 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 71.646 |
InChI Key: | HNYNDNFOSFPOJR-UHFFFAOYSA-N |