N-(1-benzoylindazol-4-yl)-5-chloro-2-hydroxybenzamide

C21H14ClN3O3 — CID 162677061

IUPACN-(1-benzoylindazol-4-yl)-5-chloro-2-hydroxybenzamide
SMILESO=C(Nc1cccc2c1cnn2C(=O)c1ccccc1)c1cc(Cl)ccc1O
InChIInChI=1S/C21H14ClN3O3/c22-14-9-10-19(26)15(11-14)20(27)24-17-7-4-8-18-16(17)12-23-25(18)21(28)13-5-2-1-3-6-13/h1-12,26H,(H,24,27)
InChIKeyHVCKMIQHTCCQBC-UHFFFAOYSA-N
MW391.81 g/mol
LogP4.34
Rot. Bonds3

About N-(1-benzoylindazol-4-yl)-5-chloro-2-hydroxybenzamide

N-(1-benzoylindazol-4-yl)-5-chloro-2-hydroxybenzamide (PubChem CID 162677061) has the molecular formula C21H14ClN3O3 and a molecular weight of 391.81 g/mol. Its IUPAC name is N-(1-benzoylindazol-4-yl)-5-chloro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(1-benzoylindazol-4-yl)-5-chloro-2-hydroxybenzamide
PubChem CID162677061
Molecular FormulaC21H14ClN3O3
Molecular Weight391.81 g/mol
Exact Mass391.07
IUPAC NameN-(1-benzoylindazol-4-yl)-5-chloro-2-hydroxybenzamide
SMILESO=C(Nc1cccc2c1cnn2C(=O)c1ccccc1)c1cc(Cl)ccc1O
InChIInChI=1S/C21H14ClN3O3/c22-14-9-10-19(26)15(11-14)20(27)24-17-7-4-8-18-16(17)12-23-25(18)21(28)13-5-2-1-3-6-13/h1-12,26H,(H,24,27)
InChIKeyHVCKMIQHTCCQBC-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
N-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide
CID 162654219
5-chloro-2-hydroxy-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 45838541
5-chloro-2-hydroxy-N-(1H-indol-4-yl)benzamide
CID 54413444
5-chloro-2-hydroxy-N-[(E)-1-(1H-indol-2-yl)ethylideneamino]benzamide
CID 136122503
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

Frequently Asked Questions

What is the IUPAC name of N-(1-benzoylindazol-4-yl)-5-chloro-2-hydroxybenzamide?
The IUPAC name of N-(1-benzoylindazol-4-yl)-5-chloro-2-hydroxybenzamide (CID 162677061) is N-(1-benzoylindazol-4-yl)-5-chloro-2-hydroxybenzamide.
What is the SMILES notation for N-(1-benzoylindazol-4-yl)-5-chloro-2-hydroxybenzamide?
The canonical SMILES for N-(1-benzoylindazol-4-yl)-5-chloro-2-hydroxybenzamide is O=C(Nc1cccc2c1cnn2C(=O)c1ccccc1)c1cc(Cl)ccc1O.
What is the InChIKey of N-(1-benzoylindazol-4-yl)-5-chloro-2-hydroxybenzamide?
The InChIKey is HVCKMIQHTCCQBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14ClN3O3/c22-14-9-10-19(26)15(11-14)20(27)24-17-7-4-8-18-16(17)12-23-25(18)21(28)13-5-2-1-3-6-13/h1-12,26H,(H,24,27).
What are the key properties of N-(1-benzoylindazol-4-yl)-5-chloro-2-hydroxybenzamide?
N-(1-benzoylindazol-4-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-4-yl)-5-chloro-2-hydroxybenzamide is sourced from PubChem (CID 162677061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).