V023-6557 Screening compound: 2-methyl-N-(2-methylbutyl)-N-(2-{4-[(4-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)propanamide

V023-6557 Screening compound: 2-methyl-N-(2-methylbutyl)-N-(2-{4-[(4-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)propanamide
V023-6557 Screening compound: 2-methyl-N-(2-methylbutyl)-N-(2-{4-[(4-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-6557
2-methyl-N-(2-methylbutyl)-N-(2-{4-[(4-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)propanamide

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

V023-6557

Molecular Formula

C26H36N2O3S (C26 H36 N2 O3 S)

Compound Name

2-methyl-N-(2-methylbutyl)-N-(2-{4-[(4-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)propanamide

IUPAC name

2-methyl-N-(2-methylbutyl)-N-(2-{4-[(4-methylphenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}-2-oxoethyl)propanamide

SMILES

CCC(C)CN(CC(N(CC1)C(COc2ccc(C)cc2)c2c1scc2)=O)C(C(C)C)=O

InChI

InChI=1S/C26H36N2O3S/c1-6-19(4)15-27(26(30)18(2)3)16-25(29)28-13-11-24-22(12-14-32-24)23(28)17-31-21-9-7-20(5)8-10-21/h7-10,12,14,18-19,23H,6,11,13,15-17H2,1-5H3

InChI Key

ICNKQAPLXYUIQI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19866445

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.65

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.813

Distribution Coefficient, logD

5.813

Water Solubility, LogSw

-5.39

Polar Surface Area

40.558

Acid Dissociation Constant (pKa)

22.33

Base Dissociation Constant (pKb)

0.75

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

53.80

References: we are preparing a list of scientific research reports with V023-6557 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V023-6557?
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What is the minimum amount of V023-6557 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-6557
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-6557
  • 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 V023-6557 available by request