C656-0383 Screening compound: 3-(4-fluorophenyl)-6-[2-oxo-2-(piperidin-1-yl)ethyl]-3H,6H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

C656-0383 Screening compound: 3-(4-fluorophenyl)-6-[2-oxo-2-(piperidin-1-yl)ethyl]-3H,6H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
C656-0383 Screening compound: 3-(4-fluorophenyl)-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 C656-0383
3-(4-fluorophenyl)-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

C656-0383

Molecular Formula

C17H17FN6O2 (C17 H17 FN6 O2)

Compound Name

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

IUPAC name

3-(4-fluorophenyl)-6-[2-oxo-2-(piperidin-1-yl)ethyl]-3H6H7H-[123]triazolo[45-d]pyrimidin-7-one

SMILES

O=C(CN(C=Nc1c2nnn1-c(cc1)ccc1F)C2=O)N1CCCCC1

InChI

InChI=1S/C17H17FN6O2/c18-12-4-6-13(7-5-12)24-16-15(20-21-24)17(26)23(11-19-16)10-14(25)22-8-2-1-3-9-22/h4-7,11H,1-3,8-10H2

InChI Key

IOQUWUIJVNTFED-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05713124

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.36

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.872

Distribution Coefficient, logD

0.872

Water Solubility, LogSw

-1.61

Polar Surface Area

69.551

Acid Dissociation Constant (pKa)

25.21

Base Dissociation Constant (pKb)

2.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

References: we are preparing a list of scientific research reports with C656-0383 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C656-0383?
Check Price and Availability of C656-0383, 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 C656-0383 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C656-0383
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C656-0383
  • 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 C656-0383 available by request