V022-5034 Screening compound: 4-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-6-phenoxypyrimidine

V022-5034 Screening compound: 4-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-6-phenoxypyrimidine
V022-5034 Screening compound: 4-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-6-phenoxypyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-5034
4-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-6-phenoxypyrimidine

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

V022-5034

Molecular Formula

C21H21ClN2OS (C21 H21 ClN2 OS)

Compound Name

4-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-6-phenoxypyrimidine

IUPAC name

4-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-6-phenoxypyrimidine

SMILES

CC(C)(C)c1nc(SCc2cccc(Cl)c2)nc(Oc2ccccc2)c1

InChI

InChI=1S/C21H21ClN2OS/c1-21(2,3)18-13-19(25-17-10-5-4-6-11-17)24-20(23-18)26-14-15-8-7-9-16(22)12-15/h4-13H,14H2,1-3H3

InChI Key

CGWMAIDBGILZAE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19889541

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

384.93

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

6.862

Distribution Coefficient, logD

6.862

Water Solubility, LogSw

-6.35

Polar Surface Area

23.908

Acid Dissociation Constant (pKa)

21.62

Base Dissociation Constant (pKb)

1.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

References: we are preparing a list of scientific research reports with V022-5034 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-5034?
Check Price and Availability of V022-5034, 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 V022-5034 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-5034
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-5034
  • 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 V022-5034 available by request