C656-0165 Screening compound: 3-[(2-fluorophenyl)methyl]-6-[2-oxo-2-(piperidin-1-yl)ethyl]-3H,6H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

C656-0165 Screening compound: 3-[(2-fluorophenyl)methyl]-6-[2-oxo-2-(piperidin-1-yl)ethyl]-3H,6H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
C656-0165 Screening compound: 3-[(2-fluorophenyl)methyl]-6-[2-oxo-2-(piperidin-1-yl)ethyl]-3H,6H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C656-0165
3-[(2-fluorophenyl)methyl]-6-[2-oxo-2-(piperidin-1-yl)ethyl]-3H,6H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

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

C656-0165

Molecular Formula

C18H19FN6O2 (C18 H19 FN6 O2)

Compound Name

3-[(2-fluorophenyl)methyl]-6-[2-oxo-2-(piperidin-1-yl)ethyl]-3H,6H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

IUPAC name

3-[(2-fluorophenyl)methyl]-6-[2-oxo-2-(piperidin-1-yl)ethyl]-3H6H7H-[123]triazolo[45-d]pyrimidin-7-one

SMILES

O=C(CN(C=Nc1c2nnn1Cc(cccc1)c1F)C2=O)N1CCCCC1

InChI

InChI=1S/C18H19FN6O2/c19-14-7-3-2-6-13(14)10-25-17-16(21-22-25)18(27)24(12-20-17)11-15(26)23-8-4-1-5-9-23/h2-3,6-7,12H,1,4-5,8-11H2

InChI Key

DQUXQTFSCQHNRL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04470969

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.048

Distribution Coefficient, logD

1.048

Water Solubility, LogSw

-1.86

Polar Surface Area

69.415

Acid Dissociation Constant (pKa)

25.21

Base Dissociation Constant (pKb)

3.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

C656-0165 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C656-0165 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C656-0165?
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What is the minimum amount of C656-0165 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C656-0165
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C656-0165
  • 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 C656-0165 available by request