C14H9Cl3N2O3 — CID 127046852
4-chloro-3-[(2,4-dichlorobenzoyl)amino]-N-hydroxybenzamide (PubChem CID 127046852) has the molecular formula C14H9Cl3N2O3 and a molecular weight of 359.60 g/mol. Its IUPAC name is 4-chloro-3-[(2,4-dichlorobenzoyl)amino]-N-hydroxybenzamide.
| Compound Name | 4-chloro-3-[(2,4-dichlorobenzoyl)amino]-N-hydroxybenzamide |
|---|---|
| PubChem CID | 127046852 |
| Molecular Formula | C14H9Cl3N2O3 |
| Molecular Weight | 359.60 g/mol |
| Exact Mass | 357.97 |
| IUPAC Name | 4-chloro-3-[(2,4-dichlorobenzoyl)amino]-N-hydroxybenzamide |
| SMILES | O=C(NO)c1ccc(Cl)c(NC(=O)c2ccc(Cl)cc2Cl)c1 |
| InChI | InChI=1S/C14H9Cl3N2O3/c15-8-2-3-9(11(17)6-8)14(21)18-12-5-7(13(20)19-22)1-4-10(12)16/h1-6,22H,(H,18,21)(H,19,20) |
| InChIKey | UYUPOQDZJBPUTQ-UHFFFAOYSA-N |
| XLogP | 4.02 |
| TPSA | 78.43 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 22 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 359.60 |
| LogP ≤ 5 | 4.02 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |
| Structural Alerts | {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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