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N-[4-[[3-butyl-1-[(2-fluorophenyl)methyl]-2,6-dioxo-7H-purin-8-yl]methyl]phenyl]acetamide

N-[4-[[3-butyl-1-[(2-fluorophenyl)methyl]-2,6-dioxo-7H-purin-8-yl]methyl]phenyl]acetamide structure

CAS No:
628279-07-2
Formula:
C25H26FN5O3
Chemical Name:
N-[4-[[3-butyl-1-[(2-fluorophenyl)methyl]-2,6-dioxo-7H-purin-8-yl]methyl]phenyl]acetamide
Synonyms:
cPEPCK inhibitor;1-(2-FLUOROBENZYL)-3-BUTYL-8-(N-ACETYL-4-AMINOBENZYL)-XANTHINE;628279-07-2;CHEMBL120708;N-{4-[1-(2-FLUOROBENZYL)-3-BUTYL-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-8-YLMETHYL]-PHENYL}-ACETAMIDE;N-[4-[1-(2-Fluorobenzyl)-3-butyl-2,6-dixo-2,3,6,7-tetrahydro-1H-purin-8-ylmethyl]phenyl]acetamide;FTB;MLS006010329;SCHEMBL3976945;BDBM50133801;ZINC15804848;DB02008;NCGC00263130-01;NCGC00263130-02;SMR004701392;FT-0668619;Q27093098;1-(2-Fluorobenzyl)-3-butyl-8-[4-(acetylamino)benzyl]-1,2,3,6-tetrahydro-7H-purine-2,6-dione;N-(4-((1-(2-fluorobenzyl)-3-butyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)methyl)phenyl)acetamide;N-(4-{[3-butyl-1-(2-fluorobenzyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}phenyl)acetamide;N-{4-[3-Butyl-1-(2-fluoro-benzyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-ylmethyl]-phenyl}-acetamide;N-{4-[3-Butyl-1-(2-fluoro-benzyl)-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-ylmethyl]-phenyl}-acetamide

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N-[4-[[3-butyl-1-[(2-fluorophenyl)methyl]-2,6-dioxo-7H-purin-8-yl]methyl]phenyl]acetamide Basic Attributes

Molecular Weight：

463.5 g/mol

Exact Mass：

463.20196787 g/mol

Characteristics

PSA：

98.4 Å²

Computed Properties

Molecular Weight:463.5
XLogP3:3.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:463.20196787
Monoisotopic Mass:463.20196787
Topological Polar Surface Area:98.4
Heavy Atom Count:34
Complexity:744
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-[4-[[3-butyl-1-[(2-fluorophenyl)methyl]-2,6-dioxo-7H-purin-8-yl]methyl]phenyl]acetamide

Basic Attributes
Characteristics
Computed Properties

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