3-{[3-(trifluoromethyl)phenyl]methyl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-{[3-(trifluoromethyl)phenyl]methyl}-1,3-benzoxazol-2(3H)-one
3-{[3-(trifluoromethyl)phenyl]methyl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | 8012-4743 |
| Compound Name: | 3-{[3-(trifluoromethyl)phenyl]methyl}-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 293.24 |
| Molecular Formula: | C15 H10 F3 N O2 |
| Smiles: | C(c1cccc(c1)C(F)(F)F)N1C(=O)Oc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.9553 |
| logD: | 3.9553 |
| logSw: | -4.2606 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 23.067 |
| InChI Key: | VBKGXURFEZUVQQ-UHFFFAOYSA-N |