V001-6702 Screening compound: ETHYL 2-{1-[(FURAN-2-YL)METHYL]-2,6-DIOXO-3-PHENYL-2,3,6,7-TETRAHYDRO-1H-PURIN-7-YL}ACETATE

V001-6702 Screening compound: ETHYL 2-{1-[(FURAN-2-YL)METHYL]-2,6-DIOXO-3-PHENYL-2,3,6,7-TETRAHYDRO-1H-PURIN-7-YL}ACETATE
V001-6702 Screening compound: ETHYL 2-{1-[(FURAN-2-YL)METHYL]-2,6-DIOXO-3-PHENYL-2,3,6,7-TETRAHYDRO-1H-PURIN-7-YL}ACETATE alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-6702
ETHYL 2-{1-[(FURAN-2-YL)METHYL]-2,6-DIOXO-3-PHENYL-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

V001-6702

Molecular Formula

C20H18N4O5 (C20 H18 N4 O5)

Compound Name

ETHYL 2-{1-[(FURAN-2-YL)METHYL]-2,6-DIOXO-3-PHENYL-2,3,6,7-TETRAHYDRO-1H-PURIN-7-YL}ACETATE

IUPAC name

n/a

SMILES

CCOC(Cn1c(C(N(Cc2ccco2)C(N2c3ccccc3)=O)=O)c2nc1)=O

InChI

InChI=1S/C20H18N4O5/c1-2-28-16(25)12-22-13-21-18-17(22)19(26)23(11-15-9-6-10-29-15)20(27)24(18)14-7-4-3-5-8-14/h3-10,13H,2,11-12H2,1H3

InChI Key

JHKVJBHWSGXOAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19920338

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

394.39

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

1.631

Distribution Coefficient, logD

1.631

Water Solubility, LogSw

-1.91

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

References: we are preparing a list of scientific research reports with V001-6702 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-6702?
Check Price and Availability of V001-6702, 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 V001-6702 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-6702
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-6702
  • 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 V001-6702 available by request