2-[5-(3-methoxy-2-methylphenyl)-1-methylindazol-3-yl]-1H-benzimidazol-4-ol

C23H20N4O2 — CID 135686892

IUPAC2-[5-(3-methoxy-2-methylphenyl)-1-methylindazol-3-yl]-1H-benzimidazol-4-ol
SMILESCOc1cccc(-c2ccc3c(c2)c(-c2nc4c(O)cccc4[nH]2)nn3C)c1C
InChIInChI=1S/C23H20N4O2/c1-13-15(6-4-9-20(13)29-3)14-10-11-18-16(12-14)21(26-27(18)2)23-24-17-7-5-8-19(28)22(17)25-23/h4-12,28H,1-3H3,(H,24,25)
InChIKeyYHOIOIVYSRSECT-UHFFFAOYSA-N
MW384.44 g/mol
LogP4.81
Rot. Bonds3

About 2-[5-(3-methoxy-2-methylphenyl)-1-methylindazol-3-yl]-1H-benzimidazol-4-ol

2-[5-(3-methoxy-2-methylphenyl)-1-methylindazol-3-yl]-1H-benzimidazol-4-ol (PubChem CID 135686892) has the molecular formula C23H20N4O2 and a molecular weight of 384.44 g/mol. Its IUPAC name is 2-[5-(3-methoxy-2-methylphenyl)-1-methylindazol-3-yl]-1H-benzimidazol-4-ol.

Molecular Properties

Compound Name2-[5-(3-methoxy-2-methylphenyl)-1-methylindazol-3-yl]-1H-benzimidazol-4-ol
PubChem CID135686892
Molecular FormulaC23H20N4O2
Molecular Weight384.44 g/mol
Exact Mass384.16
IUPAC Name2-[5-(3-methoxy-2-methylphenyl)-1-methylindazol-3-yl]-1H-benzimidazol-4-ol
SMILESCOc1cccc(-c2ccc3c(c2)c(-c2nc4c(O)cccc4[nH]2)nn3C)c1C
InChIInChI=1S/C23H20N4O2/c1-13-15(6-4-9-20(13)29-3)14-10-11-18-16(12-14)21(26-27(18)2)23-24-17-7-5-8-19(28)22(17)25-23/h4-12,28H,1-3H3,(H,24,25)
InChIKeyYHOIOIVYSRSECT-UHFFFAOYSA-N
XLogP4.81
TPSA75.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 54.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[5-(3-methoxy-2-methylphenyl)-1-methylindazol-3-yl]-1H-benzimidazol-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-tert-butyl-2-[(4-methoxyphenyl)methyl]-7-methyl-3H-benzimidazol-4-ol
CID 13971355
1-Methyl-5-(3,5,6,7-tetrahydropyrrolo[3,4-f]benzimidazol-2-yl)-3-[4-[3-(trifluoromethoxy)phenyl]phenyl]pyrazol-4-ol
CID 135988632
1-Methyl-5-(3,5,6,7-tetrahydropyrrolo[3,4-f]benzimidazol-2-yl)-3-[4-[4-(trifluoromethoxy)phenyl]phenyl]pyrazol-4-ol
CID 135988874
3-(1H-benzimidazol-2-yl)-5-(2,6-difluoro-4-methoxyphenyl)-1-methylindazole
CID 136116748
3-(1H-benzimidazol-2-yl)-5-(2,4-difluoro-6-methoxyphenyl)-1-methylindazole
CID 136116756
2-[3-tert-butyl-1-methyl-4-(trifluoromethyl)pyrazol-5-yl]-6-[2-(trifluoromethoxy)phenyl]-4-(trifluoromethyl)-1H-benzimidazole
CID 136484816
3-fluoro-5-[2-[5-(5-methoxy-3-pyridinyl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridin-4-yl]phenol
CID 136937155
5-[3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-1H-indazol-5-yl]pyridin-3-ol
CID 136937871
3-fluoro-5-[2-[5-(5-methoxy-3-pyridinyl)-1H-indazol-3-yl]-1H-imidazo[4,5-b]pyridin-7-yl]phenol
CID 136938057
5-[3-[4-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]pyridin-3-ol
CID 136938379
5-[3-[4-(3-fluoro-5-methoxyphenyl)-1H-benzimidazol-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridin-3-ol
CID 136946186
3-fluoro-5-[2-[5-(5-methoxy-3-pyridinyl)-1H-indazol-3-yl]-1,4-dihydroimidazo[4,5-b]azepin-8-yl]phenol
CID 145036972

Frequently Asked Questions

What is the IUPAC name of 2-[5-(3-methoxy-2-methylphenyl)-1-methylindazol-3-yl]-1H-benzimidazol-4-ol?
The IUPAC name of 2-[5-(3-methoxy-2-methylphenyl)-1-methylindazol-3-yl]-1H-benzimidazol-4-ol (CID 135686892) is 2-[5-(3-methoxy-2-methylphenyl)-1-methylindazol-3-yl]-1H-benzimidazol-4-ol.
What is the SMILES notation for 2-[5-(3-methoxy-2-methylphenyl)-1-methylindazol-3-yl]-1H-benzimidazol-4-ol?
The canonical SMILES for 2-[5-(3-methoxy-2-methylphenyl)-1-methylindazol-3-yl]-1H-benzimidazol-4-ol is COc1cccc(-c2ccc3c(c2)c(-c2nc4c(O)cccc4[nH]2)nn3C)c1C.
What is the InChIKey of 2-[5-(3-methoxy-2-methylphenyl)-1-methylindazol-3-yl]-1H-benzimidazol-4-ol?
The InChIKey is YHOIOIVYSRSECT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O2/c1-13-15(6-4-9-20(13)29-3)14-10-11-18-16(12-14)21(26-27(18)2)23-24-17-7-5-8-19(28)22(17)25-23/h4-12,28H,1-3H3,(H,24,25).
What are the key properties of 2-[5-(3-methoxy-2-methylphenyl)-1-methylindazol-3-yl]-1H-benzimidazol-4-ol?
2-[5-(3-methoxy-2-methylphenyl)-1-methylindazol-3-yl]-1H-benzimidazol-4-ol has a molecular weight of 384.44 g/mol, XLogP of 4.81, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(3-methoxy-2-methylphenyl)-1-methylindazol-3-yl]-1H-benzimidazol-4-ol is sourced from PubChem (CID 135686892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).