C22H19ClN2O4 — CID 1191645
4-(2-anilino-2-oxoethoxy)-N-(3-chloro-4-methoxyphenyl)benzamide (PubChem CID 1191645) has the molecular formula C22H19ClN2O4 and a molecular weight of 410.86 g/mol. Its IUPAC name is 4-(2-anilino-2-oxoethoxy)-N-(3-chloro-4-methoxyphenyl)benzamide.
| Compound Name | 4-(2-anilino-2-oxoethoxy)-N-(3-chloro-4-methoxyphenyl)benzamide |
|---|---|
| PubChem CID | 1191645 |
| Molecular Formula | C22H19ClN2O4 |
| Molecular Weight | 410.86 g/mol |
| Exact Mass | 410.10 |
| IUPAC Name | 4-(2-anilino-2-oxoethoxy)-N-(3-chloro-4-methoxyphenyl)benzamide |
| SMILES | COc1ccc(NC(=O)c2ccc(OCC(=O)Nc3ccccc3)cc2)cc1Cl |
| InChI | InChI=1S/C22H19ClN2O4/c1-28-20-12-9-17(13-19(20)23)25-22(27)15-7-10-18(11-8-15)29-14-21(26)24-16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,24,26)(H,25,27) |
| InChIKey | GZYVNANGTDVOLB-UHFFFAOYSA-N |
| XLogP | 4.62 |
| TPSA | 76.66 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 29 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 410.86 |
| LogP ≤ 5 | 4.62 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |