V031-0204 Screening compound: N-(cyclopropylmethyl)-1-(4-fluorobenzoyl)-4-(2-methylphenyl)-3-pyrrolidinecarboxamide

V031-0204 Screening compound: N-(cyclopropylmethyl)-1-(4-fluorobenzoyl)-4-(2-methylphenyl)-3-pyrrolidinecarboxamide
V031-0204 Screening compound: N-(cyclopropylmethyl)-1-(4-fluorobenzoyl)-4-(2-methylphenyl)-3-pyrrolidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-0204
N-(cyclopropylmethyl)-1-(4-fluorobenzoyl)-4-(2-methylphenyl)-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

V031-0204

Molecular Formula

C23H25FN2O2 (C23 H25 FN2 O2)

Compound Name

N-(cyclopropylmethyl)-1-(4-fluorobenzoyl)-4-(2-methylphenyl)-3-pyrrolidinecarboxamide

IUPAC name

N-(cyclopropylmethyl)-1-(4-fluorobenzoyl)-4-(2-methylphenyl)pyrrolidine-3-carboxamide

SMILES

Cc1c(C(CN(C2)C(c(cc3)ccc3F)=O)C2C(NCC2CC2)=O)cccc1

InChI

InChI=1S/C23H25FN2O2/c1-15-4-2-3-5-19(15)20-13-26(23(28)17-8-10-18(24)11-9-17)14-21(20)22(27)25-12-16-6-7-16/h2-5,8-11,16,20-21H,6-7,12-14H2,1H3,(H,25,27)

InChI Key

JSQHTNBLUGQDSV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14261584

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.46

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

3.555

Distribution Coefficient, logD

3.555

Water Solubility, LogSw

-3.60

Polar Surface Area

41.785

Acid Dissociation Constant (pKa)

14.80

Base Dissociation Constant (pKb)

-0.36

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

39.13

V031-0204 in Drug Discovery

Included in Screening Libraries

Inhibitors of beta-Catenin Signaling (7445 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V031-0204 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-0204?
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What is the minimum amount of V031-0204 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-0204
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-0204
  • 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 V031-0204 available by request