2-fluoro-6-methoxy-N-[1-(4-methoxy-benzyl)-3-(5-morpholin-4-ylmethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-benzamide

HCID 178490809
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Basic information

Standard SMILES
COc1ccc(Cn2cc(NC(=O)c3c(F)cccc3OC)c(-c3nc4cc(CN5CCOCC5)ccc4[nH]3)n2)cc1
InChIKey
TXWDFSSJGWPQRH-UHFFFAOYSA-N
Molecular formula
C31H31FN6O4
Average molar mass
570.6 g/mol
Monoisotopic mass
570.23908165

Names & identifiers

Preferred name
2-fluoro-6-methoxy-N-[1-(4-methoxy-benzyl)-3-(5-morpholin-4-ylmethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-benzamide
IUPAC
2-fluoro-6-methoxy-N-[1-[(4-methoxyphenyl)methyl]-3-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]pyrazol-4-yl]benzamide

Names & synonyms

SCHEMBL1644919TXWDFSSJGWPQRH-UHFFFAOYSA-N2-fluoro-6-methoxy-N-[1-(4-methoxy-benzyl)-3-(5-morpholin-4-ylmethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-benzamide

Database identifiers

PubChem CID
136395578

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
107 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
9
Heavy atoms
42

Related reactions

2 records
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Compound notes

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