[4-[3-(4-methoxyphenyl)benzimidazol-5-yl]phenyl]methanol

C21H18N2O2 — CID 139571338

IUPAC[4-[3-(4-methoxyphenyl)benzimidazol-5-yl]phenyl]methanol
SMILESCOc1ccc(-n2cnc3ccc(-c4ccc(CO)cc4)cc32)cc1
InChIInChI=1S/C21H18N2O2/c1-25-19-9-7-18(8-10-19)23-14-22-20-11-6-17(12-21(20)23)16-4-2-15(13-24)3-5-16/h2-12,14,24H,13H2,1H3
InChIKeyQQLHADMQBLPGJU-UHFFFAOYSA-N
MW330.39 g/mol
LogP4.19
Rot. Bonds4

About [4-[3-(4-methoxyphenyl)benzimidazol-5-yl]phenyl]methanol

[4-[3-(4-methoxyphenyl)benzimidazol-5-yl]phenyl]methanol (PubChem CID 139571338) has the molecular formula C21H18N2O2 and a molecular weight of 330.39 g/mol. Its IUPAC name is [4-[3-(4-methoxyphenyl)benzimidazol-5-yl]phenyl]methanol.

Molecular Properties

Compound Name[4-[3-(4-methoxyphenyl)benzimidazol-5-yl]phenyl]methanol
PubChem CID139571338
Molecular FormulaC21H18N2O2
Molecular Weight330.39 g/mol
Exact Mass330.14
IUPAC Name[4-[3-(4-methoxyphenyl)benzimidazol-5-yl]phenyl]methanol
SMILESCOc1ccc(-n2cnc3ccc(-c4ccc(CO)cc4)cc32)cc1
InChIInChI=1S/C21H18N2O2/c1-25-19-9-7-18(8-10-19)23-14-22-20-11-6-17(12-21(20)23)16-4-2-15(13-24)3-5-16/h2-12,14,24H,13H2,1H3
InChIKeyQQLHADMQBLPGJU-UHFFFAOYSA-N
XLogP4.19
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-bromo-1-(4-methoxyphenyl)benzimidazole
CID 71295672
6-methoxy-1-phenylbenzimidazole
CID 652633
5-[3-(4-methoxyphenyl)benzimidazol-5-yl]-3H-1,3,4-oxadiazole-2-thione
CID 25181321
(4-methoxyphenyl)methanol
CID 7738
N-[(4-methoxyphenyl)methyl]-1-(4-methylphenyl)benzimidazol-5-amine
CID 2881374
1-(4-methoxyphenyl)benzimidazol-5-amine
CID 783122
6-phenyl-1-[4-(piperidin-1-ylmethyl)phenyl]benzimidazole
CID 158199390
6-(4-chlorophenyl)-1-(3,4,5-trimethoxyphenyl)benzimidazole
CID 166635607
[4-[4-amino-3-(4-methoxyphenyl)phenyl]phenyl]methanol
CID 143026466
N-methoxy-3-[4-[(4-methylphenyl)methoxy]phenyl]benzimidazole-5-carboxamide
CID 170106123
2-[4-[5-(2,4-dimethoxyphenyl)benzimidazol-1-yl]phenyl]acetic acid
CID 118559103
[4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenyl]methanol
CID 162475875

Frequently Asked Questions

What is the IUPAC name of [4-[3-(4-methoxyphenyl)benzimidazol-5-yl]phenyl]methanol?
The IUPAC name of [4-[3-(4-methoxyphenyl)benzimidazol-5-yl]phenyl]methanol (CID 139571338) is [4-[3-(4-methoxyphenyl)benzimidazol-5-yl]phenyl]methanol.
What is the SMILES notation for [4-[3-(4-methoxyphenyl)benzimidazol-5-yl]phenyl]methanol?
The canonical SMILES for [4-[3-(4-methoxyphenyl)benzimidazol-5-yl]phenyl]methanol is COc1ccc(-n2cnc3ccc(-c4ccc(CO)cc4)cc32)cc1.
What is the InChIKey of [4-[3-(4-methoxyphenyl)benzimidazol-5-yl]phenyl]methanol?
The InChIKey is QQLHADMQBLPGJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2O2/c1-25-19-9-7-18(8-10-19)23-14-22-20-11-6-17(12-21(20)23)16-4-2-15(13-24)3-5-16/h2-12,14,24H,13H2,1H3.
What are the key properties of [4-[3-(4-methoxyphenyl)benzimidazol-5-yl]phenyl]methanol?
[4-[3-(4-methoxyphenyl)benzimidazol-5-yl]phenyl]methanol has a molecular weight of 330.39 g/mol, XLogP of 4.19, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[3-(4-methoxyphenyl)benzimidazol-5-yl]phenyl]methanol is sourced from PubChem (CID 139571338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).