N-[2-chloro-5-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)phenyl]-2,2,3,3,4,4,4-heptafluorobutanamide
Chemical Structure Depiction of
N-[2-chloro-5-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)phenyl]-2,2,3,3,4,4,4-heptafluorobutanamide
N-[2-chloro-5-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)phenyl]-2,2,3,3,4,4,4-heptafluorobutanamide
Compound characteristics
| Compound ID: | V006-1166 |
| Compound Name: | N-[2-chloro-5-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)phenyl]-2,2,3,3,4,4,4-heptafluorobutanamide |
| Molecular Weight: | 444.73 |
| Molecular Formula: | C17 H12 Cl F7 N2 O2 |
| Salt: | not_available |
| Smiles: | C1CCc2c(C1)c(c1ccc(c(c1)NC(C(C(C(F)(F)F)(F)F)(F)F)=O)[Cl])on2 |
| Stereo: | ACHIRAL |
| logP: | 6.0337 |
| logD: | 6.0305 |
| logSw: | -6.3678 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.093 |
| InChI Key: | SOIMWOIZEKMTMC-UHFFFAOYSA-N |