2,2,2-trifluoro-1-(2,3,5,6,8,9,11,12-octahydro-7H-1,4,10,13,7-benzotetraoxazacyclopentadecin-7-yl)ethan-1-one
Chemical Structure Depiction of
2,2,2-trifluoro-1-(2,3,5,6,8,9,11,12-octahydro-7H-1,4,10,13,7-benzotetraoxazacyclopentadecin-7-yl)ethan-1-one
2,2,2-trifluoro-1-(2,3,5,6,8,9,11,12-octahydro-7H-1,4,10,13,7-benzotetraoxazacyclopentadecin-7-yl)ethan-1-one
Compound characteristics
Compound ID: | 0495-0063 |
Compound Name: | 2,2,2-trifluoro-1-(2,3,5,6,8,9,11,12-octahydro-7H-1,4,10,13,7-benzotetraoxazacyclopentadecin-7-yl)ethan-1-one |
Molecular Weight: | 363.33 |
Molecular Formula: | C16 H20 F3 N O5 |
Smiles: | C1COCCOc2ccccc2OCCOCCN1C(C(F)(F)F)=O |
Stereo: | ACHIRAL |
logP: | 1.4283 |
logD: | 1.4283 |
logSw: | -1.6279 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 48.937 |
InChI Key: | HIFANQULVAUTPE-UHFFFAOYSA-N |