N-benzyl-4-cyano-N-{3-[2-(4-fluoroanilino)-2-oxoethyl]phenyl}benzamide
Chemical Structure Depiction of
N-benzyl-4-cyano-N-{3-[2-(4-fluoroanilino)-2-oxoethyl]phenyl}benzamide
N-benzyl-4-cyano-N-{3-[2-(4-fluoroanilino)-2-oxoethyl]phenyl}benzamide
Compound characteristics
| Compound ID: | V021-9465 |
| Compound Name: | N-benzyl-4-cyano-N-{3-[2-(4-fluoroanilino)-2-oxoethyl]phenyl}benzamide |
| Molecular Weight: | 463.51 |
| Molecular Formula: | C29 H22 F N3 O2 |
| Smiles: | C(C(Nc1ccc(cc1)F)=O)c1cccc(c1)N(Cc1ccccc1)C(c1ccc(C#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1605 |
| logD: | 5.1599 |
| logSw: | -5.4838 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.523 |
| InChI Key: | KCTWZZXGYSVHJI-UHFFFAOYSA-N |