G656-1201 Screening compound: 9-(3,4-dimethylphenyl)-7-ethyl-2-(2-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide

G656-1201 Screening compound: 9-(3,4-dimethylphenyl)-7-ethyl-2-(2-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
G656-1201 Screening compound: 9-(3,4-dimethylphenyl)-7-ethyl-2-(2-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G656-1201
9-(3,4-dimethylphenyl)-7-ethyl-2-(2-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

G656-1201

Molecular Formula

C22H20FN5O2 (C22 H20 FN5 O2)

Compound Name

9-(3,4-dimethylphenyl)-7-ethyl-2-(2-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide

IUPAC name

9-(34-dimethylphenyl)-7-ethyl-2-(2-fluorophenyl)-8-oxo-89-dihydro-7H-purine-6-carboxamide

SMILES

CCN(c1c(C(N)=O)nc(-c(cccc2)c2F)nc1N1c2cc(C)c(C)cc2)C1=O

InChI

InChI=1S/C22H20FN5O2/c1-4-27-18-17(19(24)29)25-20(15-7-5-6-8-16(15)23)26-21(18)28(22(27)30)14-10-9-12(2)13(3)11-14/h5-11H,4H2,1-3H3,(H2,24,29)

InChI Key

GVDGTIZKCMKCJL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27150000

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.120

Distribution Coefficient, logD

4.120

Water Solubility, LogSw

-4.47

Polar Surface Area

72.803

Acid Dissociation Constant (pKa)

13.04

Base Dissociation Constant (pKb)

-1.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

G656-1201 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G656-1201 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G656-1201?
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What is the minimum amount of G656-1201 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G656-1201
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G656-1201
  • 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 G656-1201 available by request