[6-chloro-5-[(4-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol

C15H12Cl2N2O2 — CID 135358756

IUPAC[6-chloro-5-[(4-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol
SMILESOCc1nc2cc(OCc3ccc(Cl)cc3)c(Cl)cc2[nH]1
InChIInChI=1S/C15H12Cl2N2O2/c16-10-3-1-9(2-4-10)8-21-14-6-13-12(5-11(14)17)18-15(7-20)19-13/h1-6,20H,7-8H2,(H,18,19)
InChIKeyPRYNCVRHKHHFMJ-UHFFFAOYSA-N
MW323.18 g/mol
LogP3.94
Rot. Bonds4

About [6-chloro-5-[(4-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol

[6-chloro-5-[(4-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol (PubChem CID 135358756) has the molecular formula C15H12Cl2N2O2 and a molecular weight of 323.18 g/mol. Its IUPAC name is [6-chloro-5-[(4-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol.

Molecular Properties

Compound Name[6-chloro-5-[(4-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol
PubChem CID135358756
Molecular FormulaC15H12Cl2N2O2
Molecular Weight323.18 g/mol
Exact Mass322.03
IUPAC Name[6-chloro-5-[(4-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol
SMILESOCc1nc2cc(OCc3ccc(Cl)cc3)c(Cl)cc2[nH]1
InChIInChI=1S/C15H12Cl2N2O2/c16-10-3-1-9(2-4-10)8-21-14-6-13-12(5-11(14)17)18-15(7-20)19-13/h1-6,20H,7-8H2,(H,18,19)
InChIKeyPRYNCVRHKHHFMJ-UHFFFAOYSA-N
XLogP3.94
TPSA58.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.18
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[6-chloro-5-[(3-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol
CID 135358909
6-chloro-5-[(4-chlorophenyl)methoxy]-1H-benzimidazole-2-carboxylic acid;ethane
CID 142453994
[4,5-dichloro-6-[(4-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol
CID 135359035
2-[(4-chlorophenoxy)methyl]-5,6-difluoro-1H-benzimidazole
CID 60979188
4-[(6-chloro-1H-benzimidazol-2-yl)methoxy]-3-[(4-methylphenyl)methoxy]benzoic acid
CID 59886987
2-[(2,4-dichlorophenoxy)methyl]-3H-benzimidazole-5-carboxylic acid
CID 24812205
[3-chloro-6-[(4-chlorophenyl)methoxy]-2-pyridinyl]methanol
CID 65126484
5,6-dichloro-2-[(2-methoxy-4-prop-2-enylphenoxy)methyl]-1H-benzimidazole
CID 50754078
6-chloro-2-[(2-methylphenoxy)methyl]-1H-benzimidazole
CID 26820083
5,6-dichloro-2-[(3-chlorophenoxy)methyl]-1H-benzimidazole
CID 82004585
N-(1H-benzimidazol-2-ylmethyl)-1-(3-chloro-4-phenylmethoxyphenyl)methanamine
CID 66526609
3-chloro-4-[(4-chlorophenyl)methoxy]benzaldehyde
CID 818787

Frequently Asked Questions

What is the IUPAC name of [6-chloro-5-[(4-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol?
The IUPAC name of [6-chloro-5-[(4-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol (CID 135358756) is [6-chloro-5-[(4-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol.
What is the SMILES notation for [6-chloro-5-[(4-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol?
The canonical SMILES for [6-chloro-5-[(4-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol is OCc1nc2cc(OCc3ccc(Cl)cc3)c(Cl)cc2[nH]1.
What is the InChIKey of [6-chloro-5-[(4-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol?
The InChIKey is PRYNCVRHKHHFMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N2O2/c16-10-3-1-9(2-4-10)8-21-14-6-13-12(5-11(14)17)18-15(7-20)19-13/h1-6,20H,7-8H2,(H,18,19).
What are the key properties of [6-chloro-5-[(4-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol?
[6-chloro-5-[(4-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol has a molecular weight of 323.18 g/mol, XLogP of 3.94, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-chloro-5-[(4-chlorophenyl)methoxy]-1H-benzimidazol-2-yl]methanol is sourced from PubChem (CID 135358756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).