2-[4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)phenoxy]acetic acid

Compound number:
MolPort-023-277-106
CAS number: 96865-83-7
IUPAC:
2-[4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)phenoxy]acetic acid
IUPAC traditional:
4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)phenoxyacetic acid
SMILES:
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(O)=O)cc1
InChI key:
QTMMGCYGCFXBFI-UHFFFAOYSA-N
Molecular formula:
C19H22N4O5
Molecular weight: 386.408
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Supplier Catalogue Data


Catalog: Screening compound Ships out: 5 business days Purity: >98%
Last updated: last month In warehouse: Unverified
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10 mg September 27, 2019 179.36 USD
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50 mg September 27, 2019 650.18 USD
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More Information

Compound Identifiers
Compound number: MolPort-023-277-106
CAS number: 96865-83-7

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000005114736
[4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)phenoxy]acetic acid
XCC

InChI
InChI: 1S/C19H22N4O5/c1-3-9-22-17-15(18(26)23(10-4-2)19(22)27)20-16(21-17)12-5-7-13(8-6-12)28-11-14(24)25/h5-8H,3-4,9-11H2,1-2H3,(H,20,21)(H,24,25)
InChI key: QTMMGCYGCFXBFI-UHFFFAOYSA-N

Calculated Properties
Molecular formula: C19H22N4O5
Molecular weight: 386.408

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2019 MolPort, v3.16, release date 11-09-2019 16:00 (+0200). All rights reserved.
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