K061-0255 Screening compound: 3-chloro-N-[3-nitro-5-(pyridin-3-yloxy)phenyl]-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

K061-0255 Screening compound: 3-chloro-N-[3-nitro-5-(pyridin-3-yloxy)phenyl]-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
K061-0255 Screening compound: 3-chloro-N-[3-nitro-5-(pyridin-3-yloxy)phenyl]-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K061-0255
3-chloro-N-[3-nitro-5-(pyridin-3-yloxy)phenyl]-5-(thiophen-2-yl)-7-(trifluoromethyl)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

K061-0255

Molecular Formula

C23H12ClF3N6O4S (C23 H12 ClF3 N6 O4 S)

Compound Name

3-chloro-N-[3-nitro-5-(pyridin-3-yloxy)phenyl]-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

IUPAC name

3-chloro-N-[3-nitro-5-(pyridin-3-yloxy)phenyl]-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[15-a]pyrimidine-2-carboxamide

SMILES

[O-][N+](c1cc(NC(c2nn3c(C(F)(F)F)cc(-c4cccs4)nc3c2Cl)=O)cc(Oc2cnccc2)c1)=O

InChI

InChI=1S/C23H12ClF3N6O4S/c24-19-20(31-32-18(23(25,26)27)10-16(30-21(19)32)17-4-2-6-38-17)22(34)29-12-7-13(33(35)36)9-15(8-12)37-14-3-1-5-28-11-14/h1-11H,(H,29,34)

InChI Key

ICJSXURHPPTEIO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01010116

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

560.9

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

5.832

Distribution Coefficient, logD

5.810

Water Solubility, LogSw

-6.19

Polar Surface Area

93.471

Acid Dissociation Constant (pKa)

8.69

Base Dissociation Constant (pKb)

3.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

References: we are preparing a list of scientific research reports with K061-0255 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K061-0255?
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What is the minimum amount of K061-0255 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K061-0255
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K061-0255
  • 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 K061-0255 available by request