P719-0580F Screening compound: 2-ethyl-1-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-7-sulfonamide

P719-0580F Screening compound: 2-ethyl-1-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-7-sulfonamide
P719-0580F Screening compound: 2-ethyl-1-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-7-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P719-0580F
2-ethyl-1-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-7-sulfonamide

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

P719-0580F

Molecular Formula

C17H18F3N3O3S (C17 H18 F3 N3 O3 S)

Compound Name

2-ethyl-1-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-7-sulfonamide

IUPAC name

2-ethyl-1-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-1H2H3H4H-pyrrolo[12-a]pyrazine-7-sulfonamide

SMILES

CCN(CCn1c2cc(S(NCc3c(C(F)(F)F)cccc3)(=O)=O)c1)C2=O

InChI

InChI=1S/C17H18F3N3O3S/c1-2-22-7-8-23-11-13(9-15(23)16(22)24)27(25,26)21-10-12-5-3-4-6-14(12)17(18,19)20/h3-6,9,11,21H,2,7-8,10H2,1H3

InChI Key

HRHOYMSTYFNIJR-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.599

Distribution Coefficient, logD

2.598

Water Solubility, LogSw

-3.16

Polar Surface Area

60.733

Acid Dissociation Constant (pKa)

10.06

Base Dissociation Constant (pKb)

-2.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

References: we are preparing a list of scientific research reports with P719-0580F chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P719-0580F?
Check Price and Availability of P719-0580F, 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 P719-0580F you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P719-0580F
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P719-0580F
  • 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 P719-0580F available by request