G656-0002 Screening compound: ethyl 2-[6-carbamoyl-2,9-bis(3-chlorophenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate

G656-0002 Screening compound: ethyl 2-[6-carbamoyl-2,9-bis(3-chlorophenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate
G656-0002 Screening compound: ethyl 2-[6-carbamoyl-2,9-bis(3-chlorophenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound G656-0002
ethyl 2-[6-carbamoyl-2,9-bis(3-chlorophenyl)-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

G656-0002

Molecular Formula

C22H17Cl2N5O4 (C22 H17 Cl2 N5 O4)

Compound Name

ethyl 2-[6-carbamoyl-2,9-bis(3-chlorophenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate

IUPAC name

ethyl 2-[6-carbamoyl-29-bis(3-chlorophenyl)-8-oxo-89-dihydro-7H-purin-7-yl]acetate

SMILES

CCOC(CN(c1c(C(N)=O)nc(-c2cc(Cl)ccc2)nc1N1c2cccc(Cl)c2)C1=O)=O

InChI

InChI=1S/C22H17Cl2N5O4/c1-2-33-16(30)11-28-18-17(19(25)31)26-20(12-5-3-6-13(23)9-12)27-21(18)29(22(28)32)15-8-4-7-14(24)10-15/h3-10H,2,11H2,1H3,(H2,25,31)

InChI Key

OMYJGZCFHHKNLN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27149720

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.31

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

4.890

Distribution Coefficient, logD

4.890

Water Solubility, LogSw

-4.82

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

G656-0002 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 G656-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G656-0002?
Check Price and Availability of G656-0002, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G656-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G656-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G656-0002
  • 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 G656-0002 available by request