N-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide

C21H14ClN3O3 — CID 162654219

IUPACN-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide
SMILESO=C(Nc1ccc2c(cnn2C(=O)c2ccccc2)c1)c1cc(Cl)ccc1O
InChIInChI=1S/C21H14ClN3O3/c22-15-6-9-19(26)17(11-15)20(27)24-16-7-8-18-14(10-16)12-23-25(18)21(28)13-4-2-1-3-5-13/h1-12,26H,(H,24,27)
InChIKeyQXTWNMWVWWROGZ-UHFFFAOYSA-N
MW391.81 g/mol
LogP4.34
Rot. Bonds3

About N-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide

N-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide (PubChem CID 162654219) has the molecular formula C21H14ClN3O3 and a molecular weight of 391.81 g/mol. Its IUPAC name is N-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide
PubChem CID162654219
Molecular FormulaC21H14ClN3O3
Molecular Weight391.81 g/mol
Exact Mass391.07
IUPAC NameN-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide
SMILESO=C(Nc1ccc2c(cnn2C(=O)c2ccccc2)c1)c1cc(Cl)ccc1O
InChIInChI=1S/C21H14ClN3O3/c22-15-6-9-19(26)17(11-15)20(27)24-16-7-8-18-14(10-16)12-23-25(18)21(28)13-4-2-1-3-5-13/h1-12,26H,(H,24,27)
InChIKeyQXTWNMWVWWROGZ-UHFFFAOYSA-N
XLogP4.34
TPSA84.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.81
LogP ≤ 54.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-2-hydroxy-N'-[(1E)-1H-indol-3-ylmethylene]benzohydrazide
CID 135716872
5-chloro-N-[2-chloro-4-(1H-indazol-6-ylmethylamino)phenyl]-2-hydroxybenzamide
CID 162650964
5-chloro-2-hydroxy-N-(1H-indol-4-yl)benzamide
CID 54413444
(2-Hydroxyphenyl)-n-(3-phenyl(1h-indazole-5-yl))carboxamide
CID 20789025
4-[(5-chloro-2-hydroxybenzoyl)amino]-N,N-dimethylindazole-2-carboxamide
CID 162645164
3-[4-[(5-Chloro-2-hydroxybenzoyl)amino]indazol-2-yl]propanoic acid
CID 162645379
4-[(5-chloro-2-hydroxybenzoyl)amino]-N-(4-methoxyphenyl)indazole-1-carboxamide
CID 162646382
5-chloro-2-hydroxy-N-(1H-indazol-6-yl)benzamide
CID 162648074
N-(1-benzoylindol-5-yl)-5-chloro-2-hydroxybenzamide
CID 162648350
5-chloro-2-hydroxy-N-(1H-indazol-4-yl)benzamide
CID 162651675
5-chloro-2-hydroxy-N-(1H-indazol-5-yl)benzamide
CID 162652371
Methyl 3-[4-[(5-chloro-2-hydroxybenzoyl)amino]indazol-2-yl]propanoate
CID 162652629

Frequently Asked Questions

What is the IUPAC name of N-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide?
The IUPAC name of N-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide (CID 162654219) is N-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide.
What is the SMILES notation for N-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide?
The canonical SMILES for N-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide is O=C(Nc1ccc2c(cnn2C(=O)c2ccccc2)c1)c1cc(Cl)ccc1O.
What is the InChIKey of N-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide?
The InChIKey is QXTWNMWVWWROGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14ClN3O3/c22-15-6-9-19(26)17(11-15)20(27)24-16-7-8-18-14(10-16)12-23-25(18)21(28)13-4-2-1-3-5-13/h1-12,26H,(H,24,27).
What are the key properties of N-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide?
N-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide has a molecular weight of 391.81 g/mol, XLogP of 4.34, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide is sourced from PubChem (CID 162654219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).