ethyl 3-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]-4-phenylpentanoate
Chemical Structure Depiction of
ethyl 3-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]-4-phenylpentanoate
ethyl 3-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]-4-phenylpentanoate
Compound characteristics
Compound ID: | 6517-0037 |
Compound Name: | ethyl 3-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]-4-phenylpentanoate |
Molecular Weight: | 412.51 |
Molecular Formula: | C22 H24 N2 O4 S |
Smiles: | CCOC(CC(C(C)c1ccccc1)C(Nc1nc2ccc(cc2s1)OC)=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 5.0065 |
logD: | 5.006 |
logSw: | -4.4989 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.793 |
InChI Key: | FUGBXGXESOXNLJ-UHFFFAOYSA-N |