N-{[4-(2-methyl-2H-tetrazol-5-yl)phenoxy]acetyl}-beta-alanine
Chemical Structure Depiction of
N-{[4-(2-methyl-2H-tetrazol-5-yl)phenoxy]acetyl}-beta-alanine
N-{[4-(2-methyl-2H-tetrazol-5-yl)phenoxy]acetyl}-beta-alanine
Compound characteristics
| Compound ID: | Y043-4811 |
| Compound Name: | N-{[4-(2-methyl-2H-tetrazol-5-yl)phenoxy]acetyl}-beta-alanine |
| Molecular Weight: | 305.29 |
| Molecular Formula: | C13 H15 N5 O4 |
| Smiles: | Cn1nc(c2ccc(cc2)OCC(NCCC(O)=O)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | -0.8921 |
| logD: | -3.5878 |
| logSw: | -1.5771 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.571 |
| InChI Key: | QQUUCQIXMSBEEZ-UHFFFAOYSA-N |