3-(3,4,5-trifluorophenyl)-1,2-benzoxazol-6-yl 3,4,5-trimethoxybenzoate
Chemical Structure Depiction of
3-(3,4,5-trifluorophenyl)-1,2-benzoxazol-6-yl 3,4,5-trimethoxybenzoate
3-(3,4,5-trifluorophenyl)-1,2-benzoxazol-6-yl 3,4,5-trimethoxybenzoate
Compound characteristics
Compound ID: | Y042-9986 |
Compound Name: | 3-(3,4,5-trifluorophenyl)-1,2-benzoxazol-6-yl 3,4,5-trimethoxybenzoate |
Molecular Weight: | 459.38 |
Molecular Formula: | C23 H16 F3 N O6 |
Smiles: | COc1cc(cc(c1OC)OC)C(=O)Oc1ccc2c(c3cc(c(c(c3)F)F)F)noc2c1 |
Stereo: | ACHIRAL |
logP: | 4.8193 |
logD: | 4.8193 |
logSw: | -4.9235 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 65.522 |
InChI Key: | SYSZNBBKWLXRDQ-UHFFFAOYSA-N |