2-(4-Cyano-phenyl)-6-[(5-(methoxycarbonyl)pentyl)oxy]-1-(3-methoxypropyl)-benzimidazole

HCID 10181429
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Basic information

Standard SMILES
COCCCn1c(-c2ccc(C#N)cc2)nc2ccc(OCCCCCC(=O)OC)cc21
InChIKey
JFHLXZUUDMWTCO-UHFFFAOYSA-N
Molecular formula
C25H29N3O4
Average molar mass
435.5 g/mol

Names & identifiers

Preferred name
2-(4-Cyano-phenyl)-6-[(5-(methoxycarbonyl)pentyl)oxy]-1-(3-methoxypropyl)-benzimidazole
IUPAC
methyl 6-[2-(4-cyanophenyl)-3-(3-methoxypropyl)benzimidazol-5-yl]oxyhexanoate

Names & synonyms

SCHEMBL6476611JFHLXZUUDMWTCO-UHFFFAOYSA-N2-(4-Cyano-phenyl)-6-[(5-(methoxycarbonyl)pentyl)oxy]-1-(3-methoxypropyl)-benzimidazole

Database identifiers

PubChem CID
10181429

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
86.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
13
Heavy atoms
32

Related reactions

2 records
New reaction record

Linked notes

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