About 5-chloro-6-(4-chloro-2-hydroxyphenyl)-1H-quinolin-2-one
5-chloro-6-(4-chloro-2-hydroxyphenyl)-1H-quinolin-2-one (PubChem CID 169119776) has the molecular formula C15H9Cl2NO2
and a molecular weight of 306.15 g/mol. Its IUPAC name is 5-chloro-6-(4-chloro-2-hydroxyphenyl)-1H-quinolin-2-one.
Molecular Properties
| Compound Name | 5-chloro-6-(4-chloro-2-hydroxyphenyl)-1H-quinolin-2-one |
| PubChem CID | 169119776 |
| Molecular Formula | C15H9Cl2NO2 |
| Molecular Weight | 306.15 g/mol |
| Exact Mass | 305.00 |
| IUPAC Name | 5-chloro-6-(4-chloro-2-hydroxyphenyl)-1H-quinolin-2-one |
| SMILES | O=c1ccc2c(Cl)c(-c3ccc(Cl)cc3O)ccc2[nH]1 |
| InChI | InChI=1S/C15H9Cl2NO2/c16-8-1-2-9(13(19)7-8)10-3-5-12-11(15(10)17)4-6-14(20)18-12/h1-7,19H,(H,18,20) |
| InChIKey | YOZMGHRLEZNTRA-UHFFFAOYSA-N |
| XLogP | 4.21 |
| TPSA | 53.09 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 306.15 |
| LogP ≤ 5 | 4.21 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 5-chloro-6-(4-chloro-2-hydroxyphenyl)-1H-quinolin-2-one?
The IUPAC name of 5-chloro-6-(4-chloro-2-hydroxyphenyl)-1H-quinolin-2-one (CID 169119776) is 5-chloro-6-(4-chloro-2-hydroxyphenyl)-1H-quinolin-2-one.
What is the SMILES notation for 5-chloro-6-(4-chloro-2-hydroxyphenyl)-1H-quinolin-2-one?
The canonical SMILES for 5-chloro-6-(4-chloro-2-hydroxyphenyl)-1H-quinolin-2-one is O=c1ccc2c(Cl)c(-c3ccc(Cl)cc3O)ccc2[nH]1.
What is the InChIKey of 5-chloro-6-(4-chloro-2-hydroxyphenyl)-1H-quinolin-2-one?
The InChIKey is YOZMGHRLEZNTRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl2NO2/c16-8-1-2-9(13(19)7-8)10-3-5-12-11(15(10)17)4-6-14(20)18-12/h1-7,19H,(H,18,20).
What are the key properties of 5-chloro-6-(4-chloro-2-hydroxyphenyl)-1H-quinolin-2-one?
5-chloro-6-(4-chloro-2-hydroxyphenyl)-1H-quinolin-2-one has a molecular weight of 306.15 g/mol, XLogP of 4.21, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(4-chloro-2-hydroxyphenyl)-1H-quinolin-2-one is sourced from PubChem (CID 169119776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).