V018-4821 Screening compound: 1-(2-fluorobenzoyl)-4-(3-fluorophenyl)-N~3~-propyl-3-pyrrolidinecarboxamide

V018-4821 Screening compound: 1-(2-fluorobenzoyl)-4-(3-fluorophenyl)-N~3~-propyl-3-pyrrolidinecarboxamide
V018-4821 Screening compound: 1-(2-fluorobenzoyl)-4-(3-fluorophenyl)-N~3~-propyl-3-pyrrolidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-4821
1-(2-fluorobenzoyl)-4-(3-fluorophenyl)-N~3~-propyl-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

V018-4821

Molecular Formula

C21H22F2N2O2 (C21 H22 F2 N2 O2)

Compound Name

1-(2-fluorobenzoyl)-4-(3-fluorophenyl)-N~3~-propyl-3-pyrrolidinecarboxamide

IUPAC name

1-(2-fluorobenzoyl)-4-(3-fluorophenyl)-N-propylpyrrolidine-3-carboxamide

SMILES

CCCNC(C(CN(C1)C(c(cccc2)c2F)=O)C1c1cc(F)ccc1)=O

InChI

InChI=1S/C21H22F2N2O2/c1-2-10-24-20(26)18-13-25(21(27)16-8-3-4-9-19(16)23)12-17(18)14-6-5-7-15(22)11-14/h3-9,11,17-18H,2,10,12-13H2,1H3,(H,24,26)

InChI Key

PMNXIQFNUTVYPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14261761

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.126

Distribution Coefficient, logD

3.126

Water Solubility, LogSw

-3.38

Polar Surface Area

41.374

Acid Dissociation Constant (pKa)

14.40

Base Dissociation Constant (pKb)

-1.01

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

33.30

V018-4821 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V018-4821 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-4821?
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What is the minimum amount of V018-4821 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-4821
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-4821
  • 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 V018-4821 available by request