3-[(3-methoxyphenoxy)methyl]-1,2-benzoxazol-6-yl 2,2-dimethylpropanoate
Chemical Structure Depiction of
3-[(3-methoxyphenoxy)methyl]-1,2-benzoxazol-6-yl 2,2-dimethylpropanoate
3-[(3-methoxyphenoxy)methyl]-1,2-benzoxazol-6-yl 2,2-dimethylpropanoate
Compound characteristics
| Compound ID: | Y040-5422 |
| Compound Name: | 3-[(3-methoxyphenoxy)methyl]-1,2-benzoxazol-6-yl 2,2-dimethylpropanoate |
| Molecular Weight: | 355.39 |
| Molecular Formula: | C20 H21 N O5 |
| Smiles: | CC(C)(C)C(=O)Oc1ccc2c(COc3cccc(c3)OC)noc2c1 |
| Stereo: | ACHIRAL |
| logP: | 4.7696 |
| logD: | 4.7696 |
| logSw: | -4.9035 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.354 |
| InChI Key: | QKLSEQKBXFCULP-UHFFFAOYSA-N |