4-({2-tert-butyl-1-[(4,4-difluorocyclohexyl)methyl]-1H-benzimidazol-5-yl}sulfonyl)-N-ethylmorpholine-2-carboxamide

HCID 67094380
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Basic information

Standard SMILES
CCNC(=O)C1CN(S(=O)(=O)c2ccc3c(c2)nc(C(C)(C)C)n3CC2CCC(F)(F)CC2)CCO1
InChIKey
CHTLBSHFJVVCIL-UHFFFAOYSA-N
Molecular formula
C25H36F2N4O4S
Average molar mass
526.6 g/mol

Names & identifiers

Preferred name
4-({2-tert-butyl-1-[(4,4-difluorocyclohexyl)methyl]-1H-benzimidazol-5-yl}sulfonyl)-N-ethylmorpholine-2-carboxamide
IUPAC
4-[2-tert-butyl-1-[(4,4-difluorocyclohexyl)methyl]benzimidazol-5-yl]sulfonyl-N-ethylmorpholine-2-carboxamide

Names & synonyms

4-({2-tert-butyl-1-[(4,4-difluorocyclohexyl)methyl]-1H-benzimidazol-5-yl}sulfonyl)-N-ethylmorpholine-2-carboxamideSCHEMBL1609367

Database identifiers

PubChem CID
67094380

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
102 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
7
Heavy atoms
36

Related reactions

2 records
New reaction record

Compound notes

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