V018-8154 Screening compound: 4-(6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-yl)tetrahydro-1-pyrazinyl (3-fluorophenyl) sulfone

V018-8154 Screening compound: 4-(6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-yl)tetrahydro-1-pyrazinyl (3-fluorophenyl) sulfone
V018-8154 Screening compound: 4-(6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-yl)tetrahydro-1-pyrazinyl (3-fluorophenyl) sulfone alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-8154
4-(6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-yl)tetrahydro-1-pyrazinyl (3-fluorophenyl) sulfone

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

V018-8154

Molecular Formula

C18H19FN6O2S (C18 H19 FN6 O2 S)

Compound Name

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

IUPAC name

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

SMILES

O=S(c1cc(F)ccc1)(N(CC1)CCN1c1c(CCC2)c2nc2ncnn12)=O

InChI

InChI=1S/C18H19FN6O2S/c19-13-3-1-4-14(11-13)28(26,27)24-9-7-23(8-10-24)17-15-5-2-6-16(15)22-18-20-12-21-25(17)18/h1,3-4,11-12H,2,5-10H2

InChI Key

ZRYLUTMISHFWST-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19971524

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

402.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.099

Distribution Coefficient, logD

2.099

Water Solubility, LogSw

-2.53

Polar Surface Area

71.515

Acid Dissociation Constant (pKa)

19.32

Base Dissociation Constant (pKb)

0.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

V018-8154 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 V018-8154 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-8154?
Check Price and Availability of V018-8154, 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 V018-8154 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-8154
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-8154
  • 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 V018-8154 available by request