1232-0029 Screening compound: 9-[6-(iodomethyl)-2,2-dimethyl-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl]-9H-purin-6-ol

1232-0029 Screening compound: 9-[6-(iodomethyl)-2,2-dimethyl-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl]-9H-purin-6-ol
1232-0029 Screening compound: 9-[6-(iodomethyl)-2,2-dimethyl-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl]-9H-purin-6-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 1232-0029
9-[6-(iodomethyl)-2,2-dimethyl-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl]-9H-purin-6-ol

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

1232-0029

Molecular Formula

C13H15IN4O4 (C13 H15 IN4 O4)

Compound Name

9-[6-(iodomethyl)-2,2-dimethyl-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl]-9H-purin-6-ol

IUPAC name

9-[6-(iodomethyl)-22-dimethyl-tetrahydro-2H-furo[34-d][13]dioxol-4-yl]-9H-purin-6-ol

SMILES

CC1(C)OC2C(n3c4ncnc(O)c4nc3)OC(CI)C2O1

InChI

InChI=1S/C13H15IN4O4/c1-13(2)21-8-6(3-14)20-12(9(8)22-13)18-5-17-7-10(18)15-4-16-11(7)19/h4-6,8-9,12H,3H2,1-2H3,(H,15,16,19)

InChI Key

RGRDMNFXAVBYNT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00807515

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.19

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.346

Distribution Coefficient, logD

0.744

Water Solubility, LogSw

-1.33

Polar Surface Area

73.585

Acid Dissociation Constant (pKa)

6.92

Base Dissociation Constant (pKb)

-0.22

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

61.50

1232-0029 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

Nucleoside Mimetics Library (2197 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Purine Based Nucleoside Mimetics Library (1131 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Cancer
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with 1232-0029 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1232-0029?
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What is the minimum amount of 1232-0029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1232-0029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1232-0029
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 1232-0029 available by request