3209-1332 Screening compound: 4-METHYL-1-[5-(4-METHYLPHENYL)-7-(TRIFLUOROMETHYL)-4H,5H,6H,7H-PYRAZOLO[1,5-A]PYRIMIDINE-2-CARBONYL]PIPERIDINE

3209-1332 Screening compound: 4-METHYL-1-[5-(4-METHYLPHENYL)-7-(TRIFLUOROMETHYL)-4H,5H,6H,7H-PYRAZOLO[1,5-A]PYRIMIDINE-2-CARBONYL]PIPERIDINE
3209-1332 Screening compound: 4-METHYL-1-[5-(4-METHYLPHENYL)-7-(TRIFLUOROMETHYL)-4H,5H,6H,7H-PYRAZOLO[1,5-A]PYRIMIDINE-2-CARBONYL]PIPERIDINE alternative view

Chemical Structure Depiction of ChemDiv screening compound 3209-1332
4-METHYL-1-[5-(4-METHYLPHENYL)-7-(TRIFLUOROMETHYL)-4H,5H,6H,7H-PYRAZOLO[1,5-A]PYRIMIDINE-2-CARBONYL]PIPERIDINE

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

3209-1332

Molecular Formula

C21H25F3N4O (C21 H25 F3 N4 O)

Compound Name

4-METHYL-1-[5-(4-METHYLPHENYL)-7-(TRIFLUOROMETHYL)-4H,5H,6H,7H-PYRAZOLO[1,5-A]PYRIMIDINE-2-CARBONYL]PIPERIDINE

IUPAC name

4-methyl-1-[5-(4-methylphenyl)-7-(trifluoromethyl)-4H5H6H7H-pyrazolo[15-a]pyrimidine-2-carbonyl]piperidine

SMILES

CC(CC1)CCN1C(c1nn(C(CC(c2ccc(C)cc2)N2)C(F)(F)F)c2c1)=O

InChI

InChI=1S/C21H25F3N4O/c1-13-3-5-15(6-4-13)16-11-18(21(22,23)24)28-19(25-16)12-17(26-28)20(29)27-9-7-14(2)8-10-27/h3-6,12,14,16,18,25H,7-11H2,1-2H3

InChI Key

KEBRDWQRTQDEBP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01923496

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.573

Distribution Coefficient, logD

4.573

Water Solubility, LogSw

-4.34

Polar Surface Area

44.415

Acid Dissociation Constant (pKa)

18.06

Base Dissociation Constant (pKb)

-2.08

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

52.40

3209-1332 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3209-1332 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3209-1332?
Check Price and Availability of 3209-1332, 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 3209-1332 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3209-1332
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3209-1332
  • 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 3209-1332 available by request