V004-5174 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-oxo-5-{[3-(trifluoromethyl)phenyl]methyl}-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-2-carboxamide

V004-5174 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-oxo-5-{[3-(trifluoromethyl)phenyl]methyl}-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-2-carboxamide
V004-5174 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-oxo-5-{[3-(trifluoromethyl)phenyl]methyl}-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-5174
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-oxo-5-{[3-(trifluoromethyl)phenyl]methyl}-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-2-carboxamide

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

V004-5174

Molecular Formula

C26H27F3N4O4 (C26 H27 F3 N4 O4)

Compound Name

N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-oxo-5-{[3-(trifluoromethyl)phenyl]methyl}-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-2-carboxamide

IUPAC name

N-[2-(34-dimethoxyphenyl)ethyl]-N-methyl-4-oxo-5-{[3-(trifluoromethyl)phenyl]methyl}-4H5H6H7H-pyrazolo[15-a]pyrazine-2-carboxamide

SMILES

CN(CCc(cc1)cc(OC)c1OC)C(c1nn(CCN(Cc2cccc(C(F)(F)F)c2)C2=O)c2c1)=O

InChI

InChI=1S/C26H27F3N4O4/c1-31(10-9-17-7-8-22(36-2)23(14-17)37-3)24(34)20-15-21-25(35)32(11-12-33(21)30-20)16-18-5-4-6-19(13-18)26(27,28)29/h4-8,13-15H,9-12,16H2,1-3H3

InChI Key

PUAGZERFJXDZKX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19938620

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

516.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.749

Distribution Coefficient, logD

2.749

Water Solubility, LogSw

-3.01

Polar Surface Area

61.440

Acid Dissociation Constant (pKa)

26.36

Base Dissociation Constant (pKb)

-4.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

V004-5174 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V004-5174 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-5174?
Check Price and Availability of V004-5174, 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 V004-5174 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-5174
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-5174
  • 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 V004-5174 available by request