4826-0388 Screening compound: N-{5-methyl-7-phenyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}acetamide

4826-0388 Screening compound: N-{5-methyl-7-phenyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}acetamide
4826-0388 Screening compound: N-{5-methyl-7-phenyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4826-0388
N-{5-methyl-7-phenyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}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

4826-0388

Molecular Formula

C14H15N5O (C14 H15 N5 O)

Compound Name

N-{5-methyl-7-phenyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}acetamide

IUPAC name

N-{5-methyl-7-phenyl-4H7H-[124]triazolo[15-a]pyrimidin-2-yl}acetamide

SMILES

CC(Nc1nn(C(C=C(C)N2)c3ccccc3)c2n1)=O

InChI

InChI=1S/C14H15N5O/c1-9-8-12(11-6-4-3-5-7-11)19-14(15-9)17-13(18-19)16-10(2)20/h3-8,12H,1-2H3,(H2,15,16,17,18,20)/t12-/m0/s1

InChI Key

WAERKNNFVUVRDG-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD00721207

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

269.31

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.854

Distribution Coefficient, logD

1.854

Water Solubility, LogSw

-2.23

Polar Surface Area

61.826

Acid Dissociation Constant (pKa)

10.98

Base Dissociation Constant (pKb)

-1.21

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.40

4826-0388 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 4826-0388 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4826-0388?
Check Price and Availability of 4826-0388, 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 4826-0388 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4826-0388
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4826-0388
  • 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 4826-0388 available by request