7688-0072 Screening compound: 3-(4-chlorophenyl)-5-(3,4-dimethoxyphenyl)-2-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine

7688-0072 Screening compound: 3-(4-chlorophenyl)-5-(3,4-dimethoxyphenyl)-2-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
7688-0072 Screening compound: 3-(4-chlorophenyl)-5-(3,4-dimethoxyphenyl)-2-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 7688-0072
3-(4-chlorophenyl)-5-(3,4-dimethoxyphenyl)-2-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]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

7688-0072

Molecular Formula

C22H17ClF3N3O2 (C22 H17 ClF3 N3 O2)

Compound Name

3-(4-chlorophenyl)-5-(3,4-dimethoxyphenyl)-2-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine

IUPAC name

3-(4-chlorophenyl)-5-(34-dimethoxyphenyl)-2-methyl-7-(trifluoromethyl)pyrazolo[15-a]pyrimidine

SMILES

Cc1nn2c(C(F)(F)F)cc(-c(cc3)cc(OC)c3OC)nc2c1-c(cc1)ccc1Cl

InChI

InChI=1S/C22H17ClF3N3O2/c1-12-20(13-4-7-15(23)8-5-13)21-27-16(11-19(22(24,25)26)29(21)28-12)14-6-9-17(30-2)18(10-14)31-3/h4-11H,1-3H3

InChI Key

VCRFQJGUDHLUPY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06135993

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.84

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.605

Distribution Coefficient, logD

5.604

Water Solubility, LogSw

-6.38

Polar Surface Area

34.510

Acid Dissociation Constant (pKa)

28.97

Base Dissociation Constant (pKb)

4.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

7688-0072 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 7688-0072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7688-0072?
Check Price and Availability of 7688-0072, 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 7688-0072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7688-0072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7688-0072
  • 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 7688-0072 available by request