V023-4362 Screening compound: 4-[(4-tert-butylphenyl)methyl]-2-methyl-N-(prop-2-en-1-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide

V023-4362 Screening compound: 4-[(4-tert-butylphenyl)methyl]-2-methyl-N-(prop-2-en-1-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide
V023-4362 Screening compound: 4-[(4-tert-butylphenyl)methyl]-2-methyl-N-(prop-2-en-1-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-4362
4-[(4-tert-butylphenyl)methyl]-2-methyl-N-(prop-2-en-1-yl)-4H-thieno[3,2-b]pyrrole-5-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

V023-4362

Molecular Formula

C22H26N2OS (C22 H26 N2 OS)

Compound Name

4-[(4-tert-butylphenyl)methyl]-2-methyl-N-(prop-2-en-1-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide

IUPAC name

4-[(4-tert-butylphenyl)methyl]-2-methyl-N-(prop-2-en-1-yl)-4H-thieno[32-b]pyrrole-5-carboxamide

SMILES

CC(C)(C)c1ccc(Cn(c(C(NCC=C)=O)c2)c3c2sc(C)c3)cc1

InChI

InChI=1S/C22H26N2OS/c1-6-11-23-21(25)19-13-20-18(12-15(2)26-20)24(19)14-16-7-9-17(10-8-16)22(3,4)5/h6-10,12-13H,1,11,14H2,2-5H3,(H,23,25)

InChI Key

YOMMLIIVMPFCGF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19895814

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.53

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.910

Distribution Coefficient, logD

5.910

Water Solubility, LogSw

-5.48

Polar Surface Area

26.237

Acid Dissociation Constant (pKa)

13.07

Base Dissociation Constant (pKb)

-0.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

V023-4362 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with V023-4362 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V023-4362?
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What is the minimum amount of V023-4362 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-4362
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-4362
  • 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 V023-4362 available by request