N-benzyl-4-cyano-N-{3-[2-(4-methoxyanilino)-2-oxoethyl]phenyl}benzamide
Chemical Structure Depiction of
N-benzyl-4-cyano-N-{3-[2-(4-methoxyanilino)-2-oxoethyl]phenyl}benzamide
N-benzyl-4-cyano-N-{3-[2-(4-methoxyanilino)-2-oxoethyl]phenyl}benzamide
Compound characteristics
| Compound ID: | V023-8045 |
| Compound Name: | N-benzyl-4-cyano-N-{3-[2-(4-methoxyanilino)-2-oxoethyl]phenyl}benzamide |
| Molecular Weight: | 475.55 |
| Molecular Formula: | C30 H25 N3 O3 |
| Smiles: | COc1ccc(cc1)NC(Cc1cccc(c1)N(Cc1ccccc1)C(c1ccc(C#N)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1138 |
| logD: | 5.1138 |
| logSw: | -5.0508 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.067 |
| InChI Key: | USFLXMPEKQQRKQ-UHFFFAOYSA-N |