V026-7593 Screening compound: 1-(4-chlorobenzoyl)-N-(cyclopropylmethyl)-4-[3-(trifluoromethyl)phenyl]-3-pyrrolidinecarboxamide

V026-7593 Screening compound: 1-(4-chlorobenzoyl)-N-(cyclopropylmethyl)-4-[3-(trifluoromethyl)phenyl]-3-pyrrolidinecarboxamide
V026-7593 Screening compound: 1-(4-chlorobenzoyl)-N-(cyclopropylmethyl)-4-[3-(trifluoromethyl)phenyl]-3-pyrrolidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-7593
1-(4-chlorobenzoyl)-N-(cyclopropylmethyl)-4-[3-(trifluoromethyl)phenyl]-3-pyrrolidinecarboxamide

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

V026-7593

Molecular Formula

C23H22ClF3N2O2 (C23 H22 ClF3 N2 O2)

Compound Name

1-(4-chlorobenzoyl)-N-(cyclopropylmethyl)-4-[3-(trifluoromethyl)phenyl]-3-pyrrolidinecarboxamide

IUPAC name

1-(4-chlorobenzoyl)-N-(cyclopropylmethyl)-4-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide

SMILES

O=C(C(CN(C1)C(c(cc2)ccc2Cl)=O)C1c1cc(C(F)(F)F)ccc1)NCC1CC1

InChI

InChI=1S/C23H22ClF3N2O2/c24-18-8-6-15(7-9-18)22(31)29-12-19(16-2-1-3-17(10-16)23(25,26)27)20(13-29)21(30)28-11-14-4-5-14/h1-3,6-10,14,19-20H,4-5,11-13H2,(H,28,30)

InChI Key

IQTNMOICQJUOJJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14260857

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.89

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.590

Distribution Coefficient, logD

4.590

Water Solubility, LogSw

-4.94

Polar Surface Area

41.785

Acid Dissociation Constant (pKa)

14.80

Base Dissociation Constant (pKb)

0.26

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

39.10

V026-7593 in Drug Discovery

Included in Screening Libraries

Inhibitors of beta-Catenin Signaling (7445 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V026-7593 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-7593?
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What is the minimum amount of V026-7593 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-7593
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-7593
  • 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 V026-7593 available by request