V022-4355 Screening compound: 4-(2H-1,3-benzodioxol-5-yloxy)-6-ethyl-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidine

V022-4355 Screening compound: 4-(2H-1,3-benzodioxol-5-yloxy)-6-ethyl-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidine
V022-4355 Screening compound: 4-(2H-1,3-benzodioxol-5-yloxy)-6-ethyl-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-4355
4-(2H-1,3-benzodioxol-5-yloxy)-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

V022-4355

Molecular Formula

C20H17FN2O3S (C20 H17 FN2 O3 S)

Compound Name

4-(2H-1,3-benzodioxol-5-yloxy)-6-ethyl-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidine

IUPAC name

4-(2H-13-benzodioxol-5-yloxy)-6-ethyl-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidine

SMILES

CCc1nc(SCc(cc2)ccc2F)nc(Oc(cc2)cc3c2OCO3)c1

InChI

InChI=1S/C20H17FN2O3S/c1-2-15-9-19(26-16-7-8-17-18(10-16)25-12-24-17)23-20(22-15)27-11-13-3-5-14(21)6-4-13/h3-10H,2,11-12H2,1H3

InChI Key

NSOCAMCVRRFAKH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19889217

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

384.43

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

4.814

Distribution Coefficient, logD

4.814

Water Solubility, LogSw

-4.71

Polar Surface Area

41.519

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 V022-4355 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-4355?
Check Price and Availability of V022-4355, 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 V022-4355 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-4355
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-4355
  • 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 V022-4355 available by request