ethyl (2-{4-[2-(propan-2-yl)-2H-tetrazol-5-yl]benzamido}-1,3-thiazol-4-yl)acetate
Chemical Structure Depiction of
ethyl (2-{4-[2-(propan-2-yl)-2H-tetrazol-5-yl]benzamido}-1,3-thiazol-4-yl)acetate
ethyl (2-{4-[2-(propan-2-yl)-2H-tetrazol-5-yl]benzamido}-1,3-thiazol-4-yl)acetate
Compound characteristics
Compound ID: | Y043-4751 |
Compound Name: | ethyl (2-{4-[2-(propan-2-yl)-2H-tetrazol-5-yl]benzamido}-1,3-thiazol-4-yl)acetate |
Molecular Weight: | 400.46 |
Molecular Formula: | C18 H20 N6 O3 S |
Smiles: | CCOC(Cc1csc(NC(c2ccc(cc2)c2nnn(C(C)C)n2)=O)n1)=O |
Stereo: | ACHIRAL |
logP: | 3.0487 |
logD: | 2.9919 |
logSw: | -3.3538 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 92.266 |
InChI Key: | LUBYTFOGOPMOEQ-UHFFFAOYSA-N |