6049-1939 Screening compound: 3-chloro-5-(4-methoxyphenyl)-7-(trifluoromethyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxamide

6049-1939 Screening compound: 3-chloro-5-(4-methoxyphenyl)-7-(trifluoromethyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxamide
6049-1939 Screening compound: 3-chloro-5-(4-methoxyphenyl)-7-(trifluoromethyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6049-1939
3-chloro-5-(4-methoxyphenyl)-7-(trifluoromethyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxamide

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

6049-1939

Molecular Formula

C22H24ClF3N6O2 (C22 H24 ClF3 N6 O2)

Compound Name

3-chloro-5-(4-methoxyphenyl)-7-(trifluoromethyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxamide

IUPAC name

3-chloro-5-(4-methoxyphenyl)-7-(trifluoromethyl)-N-[(135-trimethyl-1H-pyrazol-4-yl)methyl]-4H5H6H7H-pyrazolo[15-a]pyrimidine-2-carboxamide

SMILES

Cc1c(CNC(c2nn(C(CC(c(cc3)ccc3OC)N3)C(F)(F)F)c3c2Cl)=O)c(C)nn1C

InChI

InChI=1S/C22H24ClF3N6O2/c1-11-15(12(2)31(3)29-11)10-27-21(33)19-18(23)20-28-16(13-5-7-14(34-4)8-6-13)9-17(22(24,25)26)32(20)30-19/h5-8,16-17,28H,9-10H2,1-4H3,(H,27,33)

InChI Key

ITPWAQDXFKEHQU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01922861

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.92

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.397

Distribution Coefficient, logD

3.397

Water Solubility, LogSw

-4.31

Polar Surface Area

72.857

Acid Dissociation Constant (pKa)

12.67

Base Dissociation Constant (pKb)

1.05

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

40.90

6049-1939 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Human Kinases Annotated Library (2415 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 6049-1939 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6049-1939?
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What is the minimum amount of 6049-1939 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6049-1939
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6049-1939
  • 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 6049-1939 available by request