V020-8346 Screening compound: ethyl 2-[1-cyclopropyl-3-(4-fluorophenyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl]propanoate

V020-8346 Screening compound: ethyl 2-[1-cyclopropyl-3-(4-fluorophenyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl]propanoate
V020-8346 Screening compound: ethyl 2-[1-cyclopropyl-3-(4-fluorophenyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl]propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-8346
ethyl 2-[1-cyclopropyl-3-(4-fluorophenyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl]propanoate

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

V020-8346

Molecular Formula

C19H19FN4O4 (C19 H19 FN4 O4)

Compound Name

ethyl 2-[1-cyclopropyl-3-(4-fluorophenyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl]propanoate

IUPAC name

ethyl 2-[1-cyclopropyl-3-(4-fluorophenyl)-26-dioxo-2367-tetrahydro-1H-purin-7-yl]propanoate

SMILES

CCOC(C(C)n1c(C(N(C2CC2)C(N2c(cc3)ccc3F)=O)=O)c2nc1)=O

InChI

InChI=1S/C19H19FN4O4/c1-3-28-18(26)11(2)22-10-21-16-15(22)17(25)24(14-8-9-14)19(27)23(16)13-6-4-12(20)5-7-13/h4-7,10-11,14H,3,8-9H2,1-2H3/t11-/m0/s1

InChI Key

LECBOXFMRMFTDU-NSHDSACASA-N

MDL Number (MFCD)

MFCD19920527

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

386.38

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.165

Distribution Coefficient, logD

2.165

Water Solubility, LogSw

-2.36

Polar Surface Area

63.264

Acid Dissociation Constant (pKa)

15.22

Base Dissociation Constant (pKb)

0.46

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.84

References: we are preparing a list of scientific research reports with V020-8346 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-8346?
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What is the minimum amount of V020-8346 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-8346
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-8346
  • 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 V020-8346 available by request