4-cyano-N-[2-(4-ethylphenyl)-6-methyl-2H-benzotriazol-5-yl]-2-fluorobenzamide
Chemical Structure Depiction of
4-cyano-N-[2-(4-ethylphenyl)-6-methyl-2H-benzotriazol-5-yl]-2-fluorobenzamide
4-cyano-N-[2-(4-ethylphenyl)-6-methyl-2H-benzotriazol-5-yl]-2-fluorobenzamide
Compound characteristics
| Compound ID: | 8290-04145 |
| Compound Name: | 4-cyano-N-[2-(4-ethylphenyl)-6-methyl-2H-benzotriazol-5-yl]-2-fluorobenzamide |
| Molecular Weight: | 399.43 |
| Molecular Formula: | C23 H18 F N5 O |
| Smiles: | CCc1ccc(cc1)n1nc2cc(C)c(cc2n1)NC(c1ccc(C#N)cc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1328 |
| logD: | 4.6419 |
| logSw: | -4.9157 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.722 |
| InChI Key: | SPJSMYRAYVUHFT-UHFFFAOYSA-N |