V008-1960 Screening compound: 4-(2H-1,3-benzodioxol-5-yloxy)-2-{[(2,5-difluorophenyl)methyl]sulfanyl}-6-ethylpyrimidine

V008-1960 Screening compound: 4-(2H-1,3-benzodioxol-5-yloxy)-2-{[(2,5-difluorophenyl)methyl]sulfanyl}-6-ethylpyrimidine
V008-1960 Screening compound: 4-(2H-1,3-benzodioxol-5-yloxy)-2-{[(2,5-difluorophenyl)methyl]sulfanyl}-6-ethylpyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-1960
4-(2H-1,3-benzodioxol-5-yloxy)-2-{[(2,5-difluorophenyl)methyl]sulfanyl}-6-ethylpyrimidine

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

V008-1960

Molecular Formula

C20H16F2N2O3S (C20 H16 F2 N2 O3 S)

Compound Name

4-(2H-1,3-benzodioxol-5-yloxy)-2-{[(2,5-difluorophenyl)methyl]sulfanyl}-6-ethylpyrimidine

IUPAC name

4-(2H-13-benzodioxol-5-yloxy)-2-{[(25-difluorophenyl)methyl]sulfanyl}-6-ethylpyrimidine

SMILES

CCc1nc(SCc(cc(cc2)F)c2F)nc(Oc(cc2)cc3c2OCO3)c1

InChI

InChI=1S/C20H16F2N2O3S/c1-2-14-8-19(27-15-4-6-17-18(9-15)26-11-25-17)24-20(23-14)28-10-12-7-13(21)3-5-16(12)22/h3-9H,2,10-11H2,1H3

InChI Key

LVBRUXCPBDGAHU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19889493

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

402.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.556

Distribution Coefficient, logD

5.556

Water Solubility, LogSw

-5.52

Polar Surface Area

41.519

Acid Dissociation Constant (pKa)

21.62

Base Dissociation Constant (pKb)

1.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with V008-1960 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-1960?
Check Price and Availability of V008-1960, 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 V008-1960 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-1960
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-1960
  • 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 V008-1960 available by request