V011-6645 Screening compound: ethyl 2-[3-(4-chlorophenyl)-1-[(furan-2-yl)methyl]-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl]acetate

V011-6645 Screening compound: ethyl 2-[3-(4-chlorophenyl)-1-[(furan-2-yl)methyl]-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl]acetate
V011-6645 Screening compound: ethyl 2-[3-(4-chlorophenyl)-1-[(furan-2-yl)methyl]-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-6645
ethyl 2-[3-(4-chlorophenyl)-1-[(furan-2-yl)methyl]-2,6-dioxo-2,3,6,7-tetrahydro-1H-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

V011-6645

Molecular Formula

C20H17ClN4O5 (C20 H17 ClN4 O5)

Compound Name

ethyl 2-[3-(4-chlorophenyl)-1-[(furan-2-yl)methyl]-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl]acetate

IUPAC name

ethyl 2-[3-(4-chlorophenyl)-1-[(furan-2-yl)methyl]-26-dioxo-2367-tetrahydro-1H-purin-7-yl]acetate

SMILES

CCOC(Cn1c(C(N(Cc2ccco2)C(N2c(cc3)ccc3Cl)=O)=O)c2nc1)=O

InChI

InChI=1S/C20H17ClN4O5/c1-2-29-16(26)11-23-12-22-18-17(23)19(27)24(10-15-4-3-9-30-15)20(28)25(18)14-7-5-13(21)6-8-14/h3-9,12H,2,10-11H2,1H3

InChI Key

BLYSHJFCOGLNPU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19920563

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

428.83

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.348

Distribution Coefficient, logD

2.348

Water Solubility, LogSw

-2.80

Polar Surface Area

70.454

Acid Dissociation Constant (pKa)

17.58

Base Dissociation Constant (pKb)

2.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

V011-6645 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V011-6645 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-6645?
Check Price and Availability of V011-6645, 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 V011-6645 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-6645
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-6645
  • 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 V011-6645 available by request