D433-0408 Screening compound: 2-(4-chlorophenoxy)-N-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)-N-(2-methoxyphenyl)acetamide

D433-0408 Screening compound: 2-(4-chlorophenoxy)-N-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)-N-(2-methoxyphenyl)acetamide
D433-0408 Screening compound: 2-(4-chlorophenoxy)-N-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)-N-(2-methoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D433-0408
2-(4-chlorophenoxy)-N-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)-N-(2-methoxyphenyl)acetamide

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

D433-0408

Molecular Formula

C23H22ClN5O3 (C23 H22 ClN5 O3)

Compound Name

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

IUPAC name

2-(4-chlorophenoxy)-N-({57-dimethyl-[124]triazolo[15-a]pyrimidin-2-yl}methyl)-N-(2-methoxyphenyl)acetamide

SMILES

Cc1cc(C)nc2nc(CN(C(COc(cc3)ccc3Cl)=O)c(cccc3)c3OC)nn12

InChI

InChI=1S/C23H22ClN5O3/c1-15-12-16(2)29-23(25-15)26-21(27-29)13-28(19-6-4-5-7-20(19)31-3)22(30)14-32-18-10-8-17(24)9-11-18/h4-12H,13-14H2,1-3H3

InChI Key

CHTYCOZPDXQJRH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27585830

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.91

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.233

Distribution Coefficient, logD

3.233

Water Solubility, LogSw

-3.53

Polar Surface Area

61.472

Acid Dissociation Constant (pKa)

22.69

Base Dissociation Constant (pKb)

1.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

D433-0408 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D433-0408 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D433-0408?
Check Price and Availability of D433-0408, 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 D433-0408 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D433-0408
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D433-0408
  • 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 D433-0408 available by request