1222-0323 Screening compound: 5-hexyl-2-[4-(trifluoromethoxy)phenyl]pyrimidine

1222-0323 Screening compound: 5-hexyl-2-[4-(trifluoromethoxy)phenyl]pyrimidine
1222-0323 Screening compound: 5-hexyl-2-[4-(trifluoromethoxy)phenyl]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 1222-0323
5-hexyl-2-[4-(trifluoromethoxy)phenyl]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

1222-0323

Molecular Formula

C17H19F3N2O (C17 H19 F3 N2 O)

Compound Name

5-hexyl-2-[4-(trifluoromethoxy)phenyl]pyrimidine

IUPAC name

5-hexyl-2-[4-(trifluoromethoxy)phenyl]pyrimidine

SMILES

CCCCCCc1cnc(-c(cc2)ccc2OC(F)(F)F)nc1

InChI

InChI=1S/C17H19F3N2O/c1-2-3-4-5-6-13-11-21-16(22-12-13)14-7-9-15(10-8-14)23-17(18,19)20/h7-12H,2-6H2,1H3

InChI Key

PDMHROZSNCANKU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01244960

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.35

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.267

Distribution Coefficient, logD

6.267

Water Solubility, LogSw

-5.43

Polar Surface Area

25.518

Acid Dissociation Constant (pKa)

21.09

Base Dissociation Constant (pKb)

2.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

References: we are preparing a list of scientific research reports with 1222-0323 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1222-0323?
Check Price and Availability of 1222-0323, 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 1222-0323 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1222-0323
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1222-0323
  • 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 1222-0323 available by request