C20H16ClN3O3 — CID 109090928
4-N-(3-chloro-4-methoxyphenyl)-2-N-phenylpyridine-2,4-dicarboxamide (PubChem CID 109090928) has the molecular formula C20H16ClN3O3 and a molecular weight of 381.82 g/mol. Its IUPAC name is 4-N-(3-chloro-4-methoxyphenyl)-2-N-phenylpyridine-2,4-dicarboxamide.
| Compound Name | 4-N-(3-chloro-4-methoxyphenyl)-2-N-phenylpyridine-2,4-dicarboxamide |
|---|---|
| PubChem CID | 109090928 |
| Molecular Formula | C20H16ClN3O3 |
| Molecular Weight | 381.82 g/mol |
| Exact Mass | 381.09 |
| IUPAC Name | 4-N-(3-chloro-4-methoxyphenyl)-2-N-phenylpyridine-2,4-dicarboxamide |
| SMILES | COc1ccc(NC(=O)c2ccnc(C(=O)Nc3ccccc3)c2)cc1Cl |
| InChI | InChI=1S/C20H16ClN3O3/c1-27-18-8-7-15(12-16(18)21)24-19(25)13-9-10-22-17(11-13)20(26)23-14-5-3-2-4-6-14/h2-12H,1H3,(H,23,26)(H,24,25) |
| InChIKey | VUDQZKTUSDMYGY-UHFFFAOYSA-N |
| XLogP | 4.25 |
| TPSA | 80.32 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 27 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 381.82 |
| LogP ≤ 5 | 4.25 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |