5-chloro-3-(5-chloro-2-methoxyphenyl)-3-hydroxy-1H-indol-2-one

C15H11Cl2NO3 — CID 67428748

IUPAC5-chloro-3-(5-chloro-2-methoxyphenyl)-3-hydroxy-1H-indol-2-one
SMILESCOc1ccc(Cl)cc1C1(O)C(=O)Nc2ccc(Cl)cc21
InChIInChI=1S/C15H11Cl2NO3/c1-21-13-5-3-9(17)7-11(13)15(20)10-6-8(16)2-4-12(10)18-14(15)19/h2-7,20H,1H3,(H,18,19)
InChIKeyWOTHBXFCDUAWPK-UHFFFAOYSA-N
MW324.16 g/mol
LogP3.19
Rot. Bonds2

About 5-chloro-3-(5-chloro-2-methoxyphenyl)-3-hydroxy-1H-indol-2-one

5-chloro-3-(5-chloro-2-methoxyphenyl)-3-hydroxy-1H-indol-2-one (PubChem CID 67428748) has the molecular formula C15H11Cl2NO3 and a molecular weight of 324.16 g/mol. Its IUPAC name is 5-chloro-3-(5-chloro-2-methoxyphenyl)-3-hydroxy-1H-indol-2-one.

Molecular Properties

Compound Name5-chloro-3-(5-chloro-2-methoxyphenyl)-3-hydroxy-1H-indol-2-one
PubChem CID67428748
Molecular FormulaC15H11Cl2NO3
Molecular Weight324.16 g/mol
Exact Mass323.01
IUPAC Name5-chloro-3-(5-chloro-2-methoxyphenyl)-3-hydroxy-1H-indol-2-one
SMILESCOc1ccc(Cl)cc1C1(O)C(=O)Nc2ccc(Cl)cc21
InChIInChI=1S/C15H11Cl2NO3/c1-21-13-5-3-9(17)7-11(13)15(20)10-6-8(16)2-4-12(10)18-14(15)19/h2-7,20H,1H3,(H,18,19)
InChIKeyWOTHBXFCDUAWPK-UHFFFAOYSA-N
XLogP3.19
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.16
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-3-hydroxy-3-(2-methoxy-6-methylphenyl)-1H-indol-2-one
CID 22560921
5-chloro-3-hydroxy-3-(3-methoxyphenyl)-1H-indol-2-one
CID 22560825
5-chloro-3-(2-chloro-4-fluorophenyl)-3-hydroxy-1H-indol-2-one
CID 18753035
(3R)-3-hydroxy-3-(2-methoxyphenyl)-1H-indol-2-one
CID 7333204
(3R)-5-bromo-3-(5-chloro-2-hydroxyphenyl)-3-hydroxy-1H-indol-2-one
CID 7353938
(3R)-5-chloro-3-hydroxy-3-[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]-1H-indol-2-one
CID 39350228
(3S)-3-(3,4-dimethoxyphenyl)-3-hydroxy-5-methyl-1H-indol-2-one
CID 7333291
5-chloro-3-ethyl-3-hydroxy-1H-indol-2-one
CID 159617645
3-[(5-chloro-2-methoxyphenyl)methyl]-5-fluoro-3-methyl-1H-indol-2-one
CID 58485436
(3R)-3-[2-amino-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]-5-chloro-3-hydroxy-1H-indol-2-one
CID 2380906
4-[[5-chloro-3-(2-methoxyphenyl)-2-oxo-1H-indol-3-yl]amino]-3,3-dimethylbutanoic acid
CID 174402555
3-(2-fluoro-5-methoxyphenyl)-3-hydroxy-1H-indol-2-one
CID 163232497

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-(5-chloro-2-methoxyphenyl)-3-hydroxy-1H-indol-2-one?
The IUPAC name of 5-chloro-3-(5-chloro-2-methoxyphenyl)-3-hydroxy-1H-indol-2-one (CID 67428748) is 5-chloro-3-(5-chloro-2-methoxyphenyl)-3-hydroxy-1H-indol-2-one.
What is the SMILES notation for 5-chloro-3-(5-chloro-2-methoxyphenyl)-3-hydroxy-1H-indol-2-one?
The canonical SMILES for 5-chloro-3-(5-chloro-2-methoxyphenyl)-3-hydroxy-1H-indol-2-one is COc1ccc(Cl)cc1C1(O)C(=O)Nc2ccc(Cl)cc21.
What is the InChIKey of 5-chloro-3-(5-chloro-2-methoxyphenyl)-3-hydroxy-1H-indol-2-one?
The InChIKey is WOTHBXFCDUAWPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2NO3/c1-21-13-5-3-9(17)7-11(13)15(20)10-6-8(16)2-4-12(10)18-14(15)19/h2-7,20H,1H3,(H,18,19).
What are the key properties of 5-chloro-3-(5-chloro-2-methoxyphenyl)-3-hydroxy-1H-indol-2-one?
5-chloro-3-(5-chloro-2-methoxyphenyl)-3-hydroxy-1H-indol-2-one has a molecular weight of 324.16 g/mol, XLogP of 3.19, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-(5-chloro-2-methoxyphenyl)-3-hydroxy-1H-indol-2-one is sourced from PubChem (CID 67428748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).