V026-5394 Screening compound: N-(tert-butyl)-N-ethyl-N-methyl-4-[3-(trifluoromethyl)phenyl]-1,3-pyrrolidinedicarboxamide

V026-5394 Screening compound: N-(tert-butyl)-N-ethyl-N-methyl-4-[3-(trifluoromethyl)phenyl]-1,3-pyrrolidinedicarboxamide
V026-5394 Screening compound: N-(tert-butyl)-N-ethyl-N-methyl-4-[3-(trifluoromethyl)phenyl]-1,3-pyrrolidinedicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-5394
N-(tert-butyl)-N-ethyl-N-methyl-4-[3-(trifluoromethyl)phenyl]-1,3-pyrrolidinedicarboxamide

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

V026-5394

Molecular Formula

C20H28F3N3O2 (C20 H28 F3 N3 O2)

Compound Name

N-(tert-butyl)-N-ethyl-N-methyl-4-[3-(trifluoromethyl)phenyl]-1,3-pyrrolidinedicarboxamide

IUPAC name

n/a

SMILES

CCN(C)C(C(CN(C1)C(NC(C)(C)C)=O)C1c1cccc(C(F)(F)F)c1)=O

InChI

InChI=1S/C20H28F3N3O2/c1-6-25(5)17(27)16-12-26(18(28)24-19(2,3)4)11-15(16)13-8-7-9-14(10-13)20(21,22)23/h7-10,15-16H,6,11-12H2,1-5H3,(H,24,28)

InChI Key

DAIVFSBHFKJROG-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.632

Distribution Coefficient, logD

3.632

Water Solubility, LogSw

-3.89

Polar Surface Area

42.233

Acid Dissociation Constant (pKa)

16.02

Base Dissociation Constant (pKb)

1.39

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

60.00

V026-5394 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Hemic and lymphatic
  • Cardiovascular
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V026-5394 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-5394?
Check Price and Availability of V026-5394, 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 V026-5394 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-5394
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-5394
  • 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 V026-5394 available by request