G656-1012 Screening compound: ethyl 2-[6-carbamoyl-2-(2-chlorophenyl)-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate

G656-1012 Screening compound: ethyl 2-[6-carbamoyl-2-(2-chlorophenyl)-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate
G656-1012 Screening compound: ethyl 2-[6-carbamoyl-2-(2-chlorophenyl)-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound G656-1012
ethyl 2-[6-carbamoyl-2-(2-chlorophenyl)-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate

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

G656-1012

Molecular Formula

C22H17ClFN5O4 (C22 H17 ClFN5 O4)

Compound Name

ethyl 2-[6-carbamoyl-2-(2-chlorophenyl)-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate

IUPAC name

ethyl 2-[6-carbamoyl-2-(2-chlorophenyl)-9-(4-fluorophenyl)-8-oxo-89-dihydro-7H-purin-7-yl]acetate

SMILES

CCOC(CN(c1c(C(N)=O)nc(-c(cccc2)c2Cl)nc1N1c(cc2)ccc2F)C1=O)=O

InChI

InChI=1S/C22H17ClFN5O4/c1-2-33-16(30)11-28-18-17(19(25)31)26-20(14-5-3-4-6-15(14)23)27-21(18)29(22(28)32)13-9-7-12(24)8-10-13/h3-10H,2,11H2,1H3,(H2,25,31)

InChI Key

IFMPUIOISDIPDV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27149941

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

469.86

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.210

Distribution Coefficient, logD

3.210

Water Solubility, LogSw

-3.66

Polar Surface Area

93.237

Acid Dissociation Constant (pKa)

13.29

Base Dissociation Constant (pKb)

-2.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

G656-1012 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Integrin Receptors Targeted library (1715 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
Targets:
  • Proteases
  • Others

References: we are preparing a list of scientific research reports with G656-1012 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G656-1012?
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What is the minimum amount of G656-1012 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G656-1012
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G656-1012
  • 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 G656-1012 available by request