methyl 1-(2,3-dichlorobenzyl)-2-(difluoromethyl)-6-morpholino-1H-benzo[d]imidazole-4-carboxylate

HCID 66976997
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Basic information

Standard SMILES
COC(=O)c1cc(N2CCOCC2)cc2c1nc(C(F)F)n2Cc1cccc(Cl)c1Cl
InChIKey
LMDQMGGLTCVSIT-UHFFFAOYSA-N
Molecular formula
C21H19Cl2F2N3O3
Average molar mass
470.3 g/mol

Names & identifiers

Preferred name
methyl 1-(2,3-dichlorobenzyl)-2-(difluoromethyl)-6-morpholino-1H-benzo[d]imidazole-4-carboxylate
IUPAC
methyl 1-[(2,3-dichlorophenyl)methyl]-2-(difluoromethyl)-6-morpholin-4-ylbenzimidazole-4-carboxylate

Names & synonyms

methyl 1-(2,3-dichlorobenzyl)-2-(difluoromethyl)-6-morpholino-1H-benzo[d]imidazole-4-carboxylateSCHEMBL1282160

Database identifiers

PubChem CID
66976997

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
56.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
31

Related reactions

20 records
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Compound notes

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