V026-5381 Screening compound: N-butyl-1-(2-methylbenzoyl)-4-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide

V026-5381 Screening compound: N-butyl-1-(2-methylbenzoyl)-4-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide
V026-5381 Screening compound: N-butyl-1-(2-methylbenzoyl)-4-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-5381
N-butyl-1-(2-methylbenzoyl)-4-(3,4,5-trimethoxyphenyl)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

V026-5381

Molecular Formula

C26H34N2O5 (C26 H34 N2 O5)

Compound Name

N-butyl-1-(2-methylbenzoyl)-4-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide

IUPAC name

N-butyl-1-(2-methylbenzoyl)-4-(345-trimethoxyphenyl)pyrrolidine-3-carboxamide

SMILES

CCCCNC(C(CN(C1)C(c2c(C)cccc2)=O)C1c(cc1OC)cc(OC)c1OC)=O

InChI

InChI=1S/C26H34N2O5/c1-6-7-12-27-25(29)21-16-28(26(30)19-11-9-8-10-17(19)2)15-20(21)18-13-22(31-3)24(33-5)23(14-18)32-4/h8-11,13-14,20-21H,6-7,12,15-16H2,1-5H3,(H,27,29)

InChI Key

KKUPWYTUAIHTKT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14261109

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.612

Distribution Coefficient, logD

3.612

Water Solubility, LogSw

-3.69

Polar Surface Area

64.352

Acid Dissociation Constant (pKa)

13.73

Base Dissociation Constant (pKb)

-1.04

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

46.20

V026-5381 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 V026-5381 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-5381?
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What is the minimum amount of V026-5381 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-5381
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-5381
  • 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 V026-5381 available by request