G656-0922 Screening compound: 2-[3-ethoxy-4-(propan-2-yloxy)phenyl]-7-ethyl-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide

G656-0922 Screening compound: 2-[3-ethoxy-4-(propan-2-yloxy)phenyl]-7-ethyl-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
G656-0922 Screening compound: 2-[3-ethoxy-4-(propan-2-yloxy)phenyl]-7-ethyl-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G656-0922
2-[3-ethoxy-4-(propan-2-yloxy)phenyl]-7-ethyl-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide

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

G656-0922

Molecular Formula

C25H26FN5O4 (C25 H26 FN5 O4)

Compound Name

2-[3-ethoxy-4-(propan-2-yloxy)phenyl]-7-ethyl-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide

IUPAC name

2-[3-ethoxy-4-(propan-2-yloxy)phenyl]-7-ethyl-9-(4-fluorophenyl)-8-oxo-89-dihydro-7H-purine-6-carboxamide

SMILES

CCN(c1c(C(N)=O)nc(-c(cc2)cc(OCC)c2OC(C)C)nc1N1c(cc2)ccc2F)C1=O

InChI

InChI=1S/C25H26FN5O4/c1-5-30-21-20(22(27)32)28-23(15-7-12-18(35-14(3)4)19(13-15)34-6-2)29-24(21)31(25(30)33)17-10-8-16(26)9-11-17/h7-14H,5-6H2,1-4H3,(H2,27,32)

InChI Key

MAJWXKSVYJDCKC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27149875

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.370

Distribution Coefficient, logD

4.370

Water Solubility, LogSw

-4.50

Polar Surface Area

86.902

Acid Dissociation Constant (pKa)

13.04

Base Dissociation Constant (pKb)

-0.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

G656-0922 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with G656-0922 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G656-0922?
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What is the minimum amount of G656-0922 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G656-0922
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G656-0922
  • 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 G656-0922 available by request