V014-2946 Screening compound: [4-(6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-yl)piperazino](3-fluorophenyl)methanone

V014-2946 Screening compound: [4-(6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-yl)piperazino](3-fluorophenyl)methanone
V014-2946 Screening compound: [4-(6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-yl)piperazino](3-fluorophenyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-2946
[4-(6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-yl)piperazino](3-fluorophenyl)methanone

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

V014-2946

Molecular Formula

C19H19FN6O (C19 H19 FN6 O)

Compound Name

[4-(6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-yl)piperazino](3-fluorophenyl)methanone

IUPAC name

2-[4-(3-fluorobenzoyl)piperazin-1-yl]-181012-tetraazatricyclo[7.3.0.0^{37}]dodeca-27911-tetraene

SMILES

O=C(c1cccc(F)c1)N(CC1)CCN1c1c(CCC2)c2nc2ncnn12

InChI

InChI=1S/C19H19FN6O/c20-14-4-1-3-13(11-14)18(27)25-9-7-24(8-10-25)17-15-5-2-6-16(15)23-19-21-12-22-26(17)19/h1,3-4,11-12H,2,5-10H2

InChI Key

NXVQFHBXPLSCSO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14286091

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

366.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.777

Distribution Coefficient, logD

1.777

Water Solubility, LogSw

-1.88

Polar Surface Area

56.452

Acid Dissociation Constant (pKa)

19.32

Base Dissociation Constant (pKb)

0.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.84

V014-2946 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 V014-2946 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-2946?
Check Price and Availability of V014-2946, 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 V014-2946 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-2946
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-2946
  • 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 V014-2946 available by request