V022-5086 Screening compound: 4-(4-chloro-3-methylphenoxy)-2-{[(3,4-difluorophenyl)methyl]sulfanyl}-6-ethylpyrimidine

V022-5086 Screening compound: 4-(4-chloro-3-methylphenoxy)-2-{[(3,4-difluorophenyl)methyl]sulfanyl}-6-ethylpyrimidine
V022-5086 Screening compound: 4-(4-chloro-3-methylphenoxy)-2-{[(3,4-difluorophenyl)methyl]sulfanyl}-6-ethylpyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-5086
4-(4-chloro-3-methylphenoxy)-2-{[(3,4-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

V022-5086

Molecular Formula

C20H17ClF2N2OS (C20 H17 ClF2 N2 OS)

Compound Name

4-(4-chloro-3-methylphenoxy)-2-{[(3,4-difluorophenyl)methyl]sulfanyl}-6-ethylpyrimidine

IUPAC name

4-(4-chloro-3-methylphenoxy)-2-{[(34-difluorophenyl)methyl]sulfanyl}-6-ethylpyrimidine

SMILES

CCc1cc(Oc(cc2)cc(C)c2Cl)nc(SCc(cc2)cc(F)c2F)n1

InChI

InChI=1S/C20H17ClF2N2OS/c1-3-14-10-19(26-15-5-6-16(21)12(2)8-15)25-20(24-14)27-11-13-4-7-17(22)18(23)9-13/h4-10H,3,11H2,1-2H3

InChI Key

FTPQXHOSYCZTJV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19889409

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

406.88

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.832

Distribution Coefficient, logD

6.832

Water Solubility, LogSw

-6.59

Polar Surface Area

24.404

Acid Dissociation Constant (pKa)

21.16

Base Dissociation Constant (pKb)

1.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with V022-5086 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-5086?
Check Price and Availability of V022-5086, 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 V022-5086 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-5086
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-5086
  • 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 V022-5086 available by request