5-chloro-N-[1-[4-(dimethylamino)benzoyl]indazol-4-yl]-2-hydroxybenzamide

C23H19ClN4O3 — CID 162662158

IUPAC5-chloro-N-[1-[4-(dimethylamino)benzoyl]indazol-4-yl]-2-hydroxybenzamide
SMILESCN(C)c1ccc(C(=O)n2ncc3c(NC(=O)c4cc(Cl)ccc4O)cccc32)cc1
InChIInChI=1S/C23H19ClN4O3/c1-27(2)16-9-6-14(7-10-16)23(31)28-20-5-3-4-19(18(20)13-25-28)26-22(30)17-12-15(24)8-11-21(17)29/h3-13,29H,1-2H3,(H,26,30)
InChIKeyGQFAXTRJYOMUAM-UHFFFAOYSA-N
MW434.88 g/mol
LogP4.40
Rot. Bonds4

About 5-chloro-N-[1-[4-(dimethylamino)benzoyl]indazol-4-yl]-2-hydroxybenzamide

5-chloro-N-[1-[4-(dimethylamino)benzoyl]indazol-4-yl]-2-hydroxybenzamide (PubChem CID 162662158) has the molecular formula C23H19ClN4O3 and a molecular weight of 434.88 g/mol. Its IUPAC name is 5-chloro-N-[1-[4-(dimethylamino)benzoyl]indazol-4-yl]-2-hydroxybenzamide.

Molecular Properties

Compound Name5-chloro-N-[1-[4-(dimethylamino)benzoyl]indazol-4-yl]-2-hydroxybenzamide
PubChem CID162662158
Molecular FormulaC23H19ClN4O3
Molecular Weight434.88 g/mol
Exact Mass434.11
IUPAC Name5-chloro-N-[1-[4-(dimethylamino)benzoyl]indazol-4-yl]-2-hydroxybenzamide
SMILESCN(C)c1ccc(C(=O)n2ncc3c(NC(=O)c4cc(Cl)ccc4O)cccc32)cc1
InChIInChI=1S/C23H19ClN4O3/c1-27(2)16-9-6-14(7-10-16)23(31)28-20-5-3-4-19(18(20)13-25-28)26-22(30)17-12-15(24)8-11-21(17)29/h3-13,29H,1-2H3,(H,26,30)
InChIKeyGQFAXTRJYOMUAM-UHFFFAOYSA-N
XLogP4.40
TPSA87.46 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.88
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

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-(1H-indol-4-yl)benzamide
CID 54413444
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
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
5-chloro-2-hydroxy-N-[2-(2-hydroxyethyl)indazol-4-yl]benzamide
CID 162653217
5-chloro-N-[1-(2,6-dichlorobenzoyl)indazol-4-yl]-2-hydroxybenzamide
CID 162656144

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[1-[4-(dimethylamino)benzoyl]indazol-4-yl]-2-hydroxybenzamide?
The IUPAC name of 5-chloro-N-[1-[4-(dimethylamino)benzoyl]indazol-4-yl]-2-hydroxybenzamide (CID 162662158) is 5-chloro-N-[1-[4-(dimethylamino)benzoyl]indazol-4-yl]-2-hydroxybenzamide.
What is the SMILES notation for 5-chloro-N-[1-[4-(dimethylamino)benzoyl]indazol-4-yl]-2-hydroxybenzamide?
The canonical SMILES for 5-chloro-N-[1-[4-(dimethylamino)benzoyl]indazol-4-yl]-2-hydroxybenzamide is CN(C)c1ccc(C(=O)n2ncc3c(NC(=O)c4cc(Cl)ccc4O)cccc32)cc1.
What is the InChIKey of 5-chloro-N-[1-[4-(dimethylamino)benzoyl]indazol-4-yl]-2-hydroxybenzamide?
The InChIKey is GQFAXTRJYOMUAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19ClN4O3/c1-27(2)16-9-6-14(7-10-16)23(31)28-20-5-3-4-19(18(20)13-25-28)26-22(30)17-12-15(24)8-11-21(17)29/h3-13,29H,1-2H3,(H,26,30).
What are the key properties of 5-chloro-N-[1-[4-(dimethylamino)benzoyl]indazol-4-yl]-2-hydroxybenzamide?
5-chloro-N-[1-[4-(dimethylamino)benzoyl]indazol-4-yl]-2-hydroxybenzamide has a molecular weight of 434.88 g/mol, XLogP of 4.40, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[1-[4-(dimethylamino)benzoyl]indazol-4-yl]-2-hydroxybenzamide is sourced from PubChem (CID 162662158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).