V021-9866 Screening compound: 4-(4-chloro-3-methylphenoxy)-6-ethyl-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidine

V021-9866 Screening compound: 4-(4-chloro-3-methylphenoxy)-6-ethyl-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidine
V021-9866 Screening compound: 4-(4-chloro-3-methylphenoxy)-6-ethyl-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-9866
4-(4-chloro-3-methylphenoxy)-6-ethyl-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidine

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

V021-9866

Molecular Formula

C20H18ClFN2OS (C20 H18 ClFN2 OS)

Compound Name

4-(4-chloro-3-methylphenoxy)-6-ethyl-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidine

IUPAC name

4-(4-chloro-3-methylphenoxy)-6-ethyl-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidine

SMILES

CCc1cc(Oc(cc2)cc(C)c2Cl)nc(SCc(cc2)ccc2F)n1

InChI

InChI=1S/C20H18ClFN2OS/c1-3-16-11-19(25-17-8-9-18(21)13(2)10-17)24-20(23-16)26-12-14-4-6-15(22)7-5-14/h4-11H,3,12H2,1-2H3

InChI Key

HPEIAOPGPMVKFD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19889219

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

388.89

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

6.358

Distribution Coefficient, logD

6.358

Water Solubility, LogSw

-6.36

Polar Surface Area

24.404

Acid Dissociation Constant (pKa)

21.55

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 V021-9866 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-9866?
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What is the minimum amount of V021-9866 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-9866
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-9866
  • 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 V021-9866 available by request