2-(1H-benzotriazol-1-yl)-N-[2-(4-fluoroanilino)-2-oxo-1-(3,4,5-trimethoxyphenyl)ethyl]-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-(1H-benzotriazol-1-yl)-N-[2-(4-fluoroanilino)-2-oxo-1-(3,4,5-trimethoxyphenyl)ethyl]-N-(4-methoxyphenyl)acetamide
2-(1H-benzotriazol-1-yl)-N-[2-(4-fluoroanilino)-2-oxo-1-(3,4,5-trimethoxyphenyl)ethyl]-N-(4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | D092-0163 |
| Compound Name: | 2-(1H-benzotriazol-1-yl)-N-[2-(4-fluoroanilino)-2-oxo-1-(3,4,5-trimethoxyphenyl)ethyl]-N-(4-methoxyphenyl)acetamide |
| Molecular Weight: | 599.62 |
| Molecular Formula: | C32 H30 F N5 O6 |
| Smiles: | COc1ccc(cc1)N(C(C(Nc1ccc(cc1)F)=O)c1cc(c(c(c1)OC)OC)OC)C(Cn1c2ccccc2nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1421 |
| logD: | 4.1406 |
| logSw: | -4.3681 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.465 |
| InChI Key: | PFGICPIOOPCJJZ-SSEXGKCCSA-N |