Methyl 4-chloro-2-[(3,5-dichloropyridin-2-yl)amino]-1-(3-hydroxypropyl)-1H-benzimidazole-7-carboxylate

HCID 68763519
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)c1ccc(Cl)c2nc(Nc3ncc(Cl)cc3Cl)n(CCCO)c12
InChIKey
TURCMXIJELXIJR-UHFFFAOYSA-N
Molecular formula
C17H15Cl3N4O3
Average molar mass
429.7 g/mol
Monoisotopic mass
428.020973

Names & identifiers

Preferred name
Methyl 4-chloro-2-[(3,5-dichloropyridin-2-yl)amino]-1-(3-hydroxypropyl)-1H-benzimidazole-7-carboxylate
IUPAC
methyl 7-chloro-2-[(3,5-dichloro-2-pyridinyl)amino]-3-(3-hydroxypropyl)benzimidazole-4-carboxylate

Names & synonyms

SCHEMBL3727780TURCMXIJELXIJR-UHFFFAOYSA-NMethyl 4-chloro-2-[(3,5-dichloropyridin-2-yl)amino]-1-(3-hydroxypropyl)-1H-benzimidazole-7-carboxylate

Database identifiers

PubChem CID
68763519

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
89.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
27

Related reactions

4 records
New reaction record

Compound notes

Loading…