Y041-7465 Screening compound: 3-[(pyrazin-2-yl)formamido]-N-(2-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}ethyl)propanamide

Y041-7465 Screening compound: 3-[(pyrazin-2-yl)formamido]-N-(2-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}ethyl)propanamide
Y041-7465 Screening compound: 3-[(pyrazin-2-yl)formamido]-N-(2-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}ethyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-7465
3-[(pyrazin-2-yl)formamido]-N-(2-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}ethyl)propanamide

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

Y041-7465

Molecular Formula

C16H17N7O2 (C16 H17 N7 O2)

Compound Name

3-[(pyrazin-2-yl)formamido]-N-(2-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}ethyl)propanamide

IUPAC name

3-[(pyrazin-2-yl)formamido]-N-(2-{[124]triazolo[43-a]pyridin-3-yl}ethyl)propanamide

SMILES

O=C(CCNC(c1nccnc1)=O)NCCc1nnc2n1cccc2

InChI

InChI=1S/C16H17N7O2/c24-15(5-7-20-16(25)12-11-17-8-9-18-12)19-6-4-14-22-21-13-3-1-2-10-23(13)14/h1-3,8-11H,4-7H2,(H,19,24)(H,20,25)

InChI Key

IAKMCUOUIHFUFE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28025576

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

339.36

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

-1.855

Distribution Coefficient, logD

-1.855

Water Solubility, LogSw

-0.99

Polar Surface Area

89.958

Acid Dissociation Constant (pKa)

13.26

Base Dissociation Constant (pKb)

0.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

Y041-7465 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 Y041-7465 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-7465?
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What is the minimum amount of Y041-7465 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-7465
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-7465
  • 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 Y041-7465 available by request