V004-6457 Screening compound: 4-(3-fluorophenyl)-1-(4-methoxybenzoyl)-N-(3-methoxypropyl)pyrrolidine-3-carboxamide

V004-6457 Screening compound: 4-(3-fluorophenyl)-1-(4-methoxybenzoyl)-N-(3-methoxypropyl)pyrrolidine-3-carboxamide
V004-6457 Screening compound: 4-(3-fluorophenyl)-1-(4-methoxybenzoyl)-N-(3-methoxypropyl)pyrrolidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-6457
4-(3-fluorophenyl)-1-(4-methoxybenzoyl)-N-(3-methoxypropyl)pyrrolidine-3-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

V004-6457

Molecular Formula

C23H27FN2O4 (C23 H27 FN2 O4)

Compound Name

4-(3-fluorophenyl)-1-(4-methoxybenzoyl)-N-(3-methoxypropyl)pyrrolidine-3-carboxamide

IUPAC name

4-(3-fluorophenyl)-1-(4-methoxybenzoyl)-N-(3-methoxypropyl)pyrrolidine-3-carboxamide

SMILES

COCCCNC(C(CN(C1)C(c(cc2)ccc2OC)=O)C1c1cccc(F)c1)=O

InChI

InChI=1S/C23H27FN2O4/c1-29-12-4-11-25-22(27)21-15-26(14-20(21)17-5-3-6-18(24)13-17)23(28)16-7-9-19(30-2)10-8-16/h3,5-10,13,20-21H,4,11-12,14-15H2,1-2H3,(H,25,27)

InChI Key

KHEUWIQTZROTEX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14261755

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.440

Distribution Coefficient, logD

2.440

Water Solubility, LogSw

-2.95

Polar Surface Area

57.261

Acid Dissociation Constant (pKa)

14.40

Base Dissociation Constant (pKb)

-1.04

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

39.10

V004-6457 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 V004-6457 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-6457?
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What is the minimum amount of V004-6457 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-6457
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-6457
  • 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 V004-6457 available by request