3-(3,4,5-trifluorophenyl)-1,2-benzoxazol-6-yl 3,4-dimethoxybenzoate
Chemical Structure Depiction of
3-(3,4,5-trifluorophenyl)-1,2-benzoxazol-6-yl 3,4-dimethoxybenzoate
3-(3,4,5-trifluorophenyl)-1,2-benzoxazol-6-yl 3,4-dimethoxybenzoate
Compound characteristics
| Compound ID: | Y040-9627 |
| Compound Name: | 3-(3,4,5-trifluorophenyl)-1,2-benzoxazol-6-yl 3,4-dimethoxybenzoate |
| Molecular Weight: | 429.35 |
| Molecular Formula: | C22 H14 F3 N O5 |
| Smiles: | COc1ccc(cc1OC)C(=O)Oc1ccc2c(c3cc(c(c(c3)F)F)F)noc2c1 |
| Stereo: | ACHIRAL |
| logP: | 4.8919 |
| logD: | 4.8919 |
| logSw: | -4.9558 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.805 |
| InChI Key: | TUHCODYLAXDIMW-UHFFFAOYSA-N |