G867-0079 Screening compound: 1-[3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]-4-(thiophene-2-sulfonyl)piperazine

G867-0079 Screening compound: 1-[3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]-4-(thiophene-2-sulfonyl)piperazine
G867-0079 Screening compound: 1-[3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]-4-(thiophene-2-sulfonyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound G867-0079
1-[3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]-4-(thiophene-2-sulfonyl)piperazine

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

G867-0079

Molecular Formula

C18H16FN7O2S2 (C18 H16 FN7 O2 S2)

Compound Name

1-[3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]-4-(thiophene-2-sulfonyl)piperazine

IUPAC name

1-[3-(4-fluorophenyl)-3H-[123]triazolo[45-d]pyrimidin-7-yl]-4-(thiophene-2-sulfonyl)piperazine

SMILES

O=S(c1cccs1)(N(CC1)CCN1c1ncnc2c1nnn2-c(cc1)ccc1F)=O

InChI

InChI=1S/C18H16FN7O2S2/c19-13-3-5-14(6-4-13)26-18-16(22-23-26)17(20-12-21-18)24-7-9-25(10-8-24)30(27,28)15-2-1-11-29-15/h1-6,11-12H,7-10H2

InChI Key

NSTHHQIBTYYWFD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08344636

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.542

Distribution Coefficient, logD

2.542

Water Solubility, LogSw

-2.58

Polar Surface Area

83.163

Acid Dissociation Constant (pKa)

21.80

Base Dissociation Constant (pKb)

3.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with G867-0079 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G867-0079?
Check Price and Availability of G867-0079, 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 G867-0079 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G867-0079
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G867-0079
  • 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 G867-0079 available by request