N-{4-chloro-3-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}-4-cyano-2-fluorobenzamide
Chemical Structure Depiction of
N-{4-chloro-3-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}-4-cyano-2-fluorobenzamide
N-{4-chloro-3-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}-4-cyano-2-fluorobenzamide
Compound characteristics
Compound ID: | 7840-3063 |
Compound Name: | N-{4-chloro-3-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}-4-cyano-2-fluorobenzamide |
Molecular Weight: | 433.87 |
Molecular Formula: | C24 H17 Cl F N3 O2 |
Smiles: | CC(C)c1ccc2c(c1)nc(c1cc(ccc1[Cl])NC(c1ccc(C#N)cc1F)=O)o2 |
Stereo: | ACHIRAL |
logP: | 6.3728 |
logD: | 6.3417 |
logSw: | -6.3118 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.196 |
InChI Key: | MXYWZBHCXXSWIZ-UHFFFAOYSA-N |