G857-2095 Screening compound: 1-(4-fluorophenyl)-2-[3-(trifluoromethyl)benzenesulfonyl]-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine

G857-2095 Screening compound: 1-(4-fluorophenyl)-2-[3-(trifluoromethyl)benzenesulfonyl]-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine
G857-2095 Screening compound: 1-(4-fluorophenyl)-2-[3-(trifluoromethyl)benzenesulfonyl]-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine alternative view

Chemical Structure Depiction of ChemDiv screening compound G857-2095
1-(4-fluorophenyl)-2-[3-(trifluoromethyl)benzenesulfonyl]-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine

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

G857-2095

Molecular Formula

C20H16F4N2O2S (C20 H16 F4 N2 O2 S)

Compound Name

1-(4-fluorophenyl)-2-[3-(trifluoromethyl)benzenesulfonyl]-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine

IUPAC name

1-(4-fluorophenyl)-2-[3-(trifluoromethyl)benzenesulfonyl]-1H2H3H4H-pyrrolo[12-a]pyrazine

SMILES

O=S(c1cc(C(F)(F)F)ccc1)(N(CCn1c2ccc1)C2c(cc1)ccc1F)=O

InChI

InChI=1S/C20H16F4N2O2S/c21-16-8-6-14(7-9-16)19-18-5-2-10-25(18)11-12-26(19)29(27,28)17-4-1-3-15(13-17)20(22,23)24/h1-10,13,19H,11-12H2/t19-/m1/s1

InChI Key

DZBUICABGWVQBA-LJQANCHMSA-N

MDL Number (MFCD)

MFCD07651629

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.813

Distribution Coefficient, logD

4.813

Water Solubility, LogSw

-4.87

Polar Surface Area

34.200

Acid Dissociation Constant (pKa)

24.35

Base Dissociation Constant (pKb)

-4.65

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

G857-2095 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Hsp90-Targeted Library (11355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with G857-2095 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G857-2095?
Check Price and Availability of G857-2095, 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 G857-2095 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G857-2095
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G857-2095
  • 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 G857-2095 available by request