G648-1166 Screening compound: 4-chloro-N-[4-({7-oxo-3H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl}methoxy)phenyl]benzamide

G648-1166 Screening compound: 4-chloro-N-[4-({7-oxo-3H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl}methoxy)phenyl]benzamide
G648-1166 Screening compound: 4-chloro-N-[4-({7-oxo-3H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl}methoxy)phenyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G648-1166
4-chloro-N-[4-({7-oxo-3H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl}methoxy)phenyl]benzamide

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

G648-1166

Molecular Formula

C19H14ClN5O3 (C19 H14 ClN5 O3)

Compound Name

4-chloro-N-[4-({7-oxo-3H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl}methoxy)phenyl]benzamide

IUPAC name

4-chloro-N-[4-({7-oxo-3H7H-[124]triazolo[15-a]pyrimidin-5-yl}methoxy)phenyl]benzamide

SMILES

O=C(c(cc1)ccc1Cl)Nc(cc1)ccc1OCC(N=C1N2N=CN1)=CC2=O

InChI

InChI=1S/C19H14ClN5O3/c20-13-3-1-12(2-4-13)18(27)23-14-5-7-16(8-6-14)28-10-15-9-17(26)25-19(24-15)21-11-22-25/h1-9,11H,10H2,(H,23,27)(H,21,22,24)

InChI Key

WVRXTZMGTPKOBE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15026016

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.8

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.030

Distribution Coefficient, logD

2.030

Water Solubility, LogSw

-3.04

Polar Surface Area

83.398

Acid Dissociation Constant (pKa)

8.50

Base Dissociation Constant (pKb)

-6.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

G648-1166 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G648-1166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G648-1166?
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What is the minimum amount of G648-1166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G648-1166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G648-1166
  • 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 G648-1166 available by request