D433-0566 Screening compound: N-benzyl-N-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)-4-fluorobenzamide

D433-0566 Screening compound: N-benzyl-N-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)-4-fluorobenzamide
D433-0566 Screening compound: N-benzyl-N-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)-4-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D433-0566
N-benzyl-N-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)-4-fluorobenzamide

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

D433-0566

Molecular Formula

C22H20FN5O (C22 H20 FN5 O)

Compound Name

N-benzyl-N-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)-4-fluorobenzamide

IUPAC name

N-benzyl-N-({57-dimethyl-[124]triazolo[15-a]pyrimidin-2-yl}methyl)-4-fluorobenzamide

SMILES

Cc1cc(C)nc2nc(CN(Cc3ccccc3)C(c(cc3)ccc3F)=O)nn12

InChI

InChI=1S/C22H20FN5O/c1-15-12-16(2)28-22(24-15)25-20(26-28)14-27(13-17-6-4-3-5-7-17)21(29)18-8-10-19(23)11-9-18/h3-12H,13-14H2,1-2H3

InChI Key

TWFDHIHZZRMBHC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27585869

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.590

Distribution Coefficient, logD

2.590

Water Solubility, LogSw

-2.92

Polar Surface Area

47.760

Acid Dissociation Constant (pKa)

25.44

Base Dissociation Constant (pKb)

2.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

D433-0566 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Agro:
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D433-0566 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D433-0566?
Check Price and Availability of D433-0566, 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 D433-0566 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D433-0566
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D433-0566
  • 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 D433-0566 available by request