HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.9
  1. Home
  2. /Compound

1-[(3,4-Dichlorophenyl)methyl]benzimidazole

HCID 799458
New noteNew reactionRequest quotesPrint preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
312631-78-0
Standard SMILES
Clc1ccc(Cn2cnc3ccccc32)cc1Cl
InChIKey
WYVNJBVHZWJCAT-UHFFFAOYSA-N
Molecular formula
C14H10Cl2N2
Average molar mass
277.1 g/mol
Monoisotopic mass
276.0221037

Names & identifiers

Preferred name
1-[(3,4-Dichlorophenyl)methyl]benzimidazole
IUPAC
1-[(3,4-dichlorophenyl)methyl]benzimidazole

Names & synonyms

312631-78-01-(3,4-dichlorobenzyl)-1H-benzimidazole1-[(3,4-dichlorophenyl)methyl]benzimidazole1-[(3,4-dichlorophenyl)methyl]-1H-1,3-benzodiazoleCambridge id 5571325CHEMBL570782SCHEMBL28326057DTXSID301240765EBC-06725N-(3,4-Dichlorobenzyl)benzimidazoleSTK059108AKOS000562551
Show more names
N-(3,4-dichlorobenzyl) benzimidazoleCCG-291486NCGC00242464-01[(3,4-dichlorophenyl)methyl]benzimidazoleST50004066AB00089765-011-[(3,4-Dichlorophenyl)methyl]-1H-benzimidazoleAG-690/11571893

Database identifiers

CAS
312631-78-0
PubChem CID
799458
DTXSID
DTXSID301240765
ChEMBL
CHEMBL570782
Nikkaji
J3.267.030J

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
17.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
18
Formal charge
0
Complexity
287

Suppliers

Loading…

Open inquiries

Loading…

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes