4-(1H-indazol-4-yl)-7-methoxy-1H-benzimidazole

C15H12N4O — CID 175786149

IUPAC4-(1H-indazol-4-yl)-7-methoxy-1H-benzimidazole
SMILESCOc1ccc(-c2cccc3[nH]ncc23)c2nc[nH]c12
InChIInChI=1S/C15H12N4O/c1-20-13-6-5-10(14-15(13)17-8-16-14)9-3-2-4-12-11(9)7-18-19-12/h2-8H,1H3,(H,16,17)(H,18,19)
InChIKeyZCEIBLXRLBWGAS-UHFFFAOYSA-N
MW264.29 g/mol
LogP3.11
Rot. Bonds2

About 4-(1H-indazol-4-yl)-7-methoxy-1H-benzimidazole

4-(1H-indazol-4-yl)-7-methoxy-1H-benzimidazole (PubChem CID 175786149) has the molecular formula C15H12N4O and a molecular weight of 264.29 g/mol. Its IUPAC name is 4-(1H-indazol-4-yl)-7-methoxy-1H-benzimidazole.

Molecular Properties

Compound Name4-(1H-indazol-4-yl)-7-methoxy-1H-benzimidazole
PubChem CID175786149
Molecular FormulaC15H12N4O
Molecular Weight264.29 g/mol
Exact Mass264.10
IUPAC Name4-(1H-indazol-4-yl)-7-methoxy-1H-benzimidazole
SMILESCOc1ccc(-c2cccc3[nH]ncc23)c2nc[nH]c12
InChIInChI=1S/C15H12N4O/c1-20-13-6-5-10(14-15(13)17-8-16-14)9-3-2-4-12-11(9)7-18-19-12/h2-8H,1H3,(H,16,17)(H,18,19)
InChIKeyZCEIBLXRLBWGAS-UHFFFAOYSA-N
XLogP3.11
TPSA66.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2,3-dihydro-1H-indol-4-yl)-7-methoxy-1H-benzimidazole
CID 175786397
4-(3-fluoro-2-methoxyphenyl)-1H-indazole
CID 167807069
4-(2,5-dihydrofuran-3-yl)-7-methoxy-1H-benzimidazole
CID 175786205
4-(4-methoxy-3-pyridinyl)-1H-benzimidazole
CID 66835930
2-N-[3-(1H-indazol-4-yl)-4-methoxyphenyl]-4-N,6-dimethylpyrimidine-2,4-diamine
CID 135154278
(7-methoxy-1H-benzimidazol-4-yl)methanol
CID 130983658
4-bromo-5-methoxy-1H-indazole
CID 46941913
5-methoxy-1H-indazol-4-amine
CID 76845989
2-(7-methoxy-1H-benzimidazol-4-yl)acetic acid
CID 131407690
4-(7-methoxy-1H-indol-4-yl)-1H-pyrazol-5-amine
CID 117328786
4,5-dimethoxy-1H-benzimidazole
CID 54423692
7-methoxy-1H-indazol-4-amine
CID 171597914

Frequently Asked Questions

What is the IUPAC name of 4-(1H-indazol-4-yl)-7-methoxy-1H-benzimidazole?
The IUPAC name of 4-(1H-indazol-4-yl)-7-methoxy-1H-benzimidazole (CID 175786149) is 4-(1H-indazol-4-yl)-7-methoxy-1H-benzimidazole.
What is the SMILES notation for 4-(1H-indazol-4-yl)-7-methoxy-1H-benzimidazole?
The canonical SMILES for 4-(1H-indazol-4-yl)-7-methoxy-1H-benzimidazole is COc1ccc(-c2cccc3[nH]ncc23)c2nc[nH]c12.
What is the InChIKey of 4-(1H-indazol-4-yl)-7-methoxy-1H-benzimidazole?
The InChIKey is ZCEIBLXRLBWGAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4O/c1-20-13-6-5-10(14-15(13)17-8-16-14)9-3-2-4-12-11(9)7-18-19-12/h2-8H,1H3,(H,16,17)(H,18,19).
What are the key properties of 4-(1H-indazol-4-yl)-7-methoxy-1H-benzimidazole?
4-(1H-indazol-4-yl)-7-methoxy-1H-benzimidazole has a molecular weight of 264.29 g/mol, XLogP of 3.11, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-indazol-4-yl)-7-methoxy-1H-benzimidazole is sourced from PubChem (CID 175786149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).