ethyl 3-[2-chloro-5-(1H-tetrazol-1-yl)anilino]-3-oxopropanoate
Chemical Structure Depiction of
ethyl 3-[2-chloro-5-(1H-tetrazol-1-yl)anilino]-3-oxopropanoate
ethyl 3-[2-chloro-5-(1H-tetrazol-1-yl)anilino]-3-oxopropanoate
Compound characteristics
Compound ID: | F517-0069 |
Compound Name: | ethyl 3-[2-chloro-5-(1H-tetrazol-1-yl)anilino]-3-oxopropanoate |
Molecular Weight: | 309.71 |
Molecular Formula: | C12 H12 Cl N5 O3 |
Smiles: | CCOC(CC(Nc1cc(ccc1[Cl])n1cnnn1)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.0189 |
logD: | 1.0189 |
logSw: | -2.6875 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 82.614 |
InChI Key: | GQOGORXTPSKIIW-UHFFFAOYSA-N |