G346-0056 Screening compound: N-(butan-2-yl)-2-(2,4-dioxo-3-{[4-(piperidine-1-carbonyl)cyclohexyl]methyl}-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl)acetamide

G346-0056 Screening compound: N-(butan-2-yl)-2-(2,4-dioxo-3-{[4-(piperidine-1-carbonyl)cyclohexyl]methyl}-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl)acetamide
G346-0056 Screening compound: N-(butan-2-yl)-2-(2,4-dioxo-3-{[4-(piperidine-1-carbonyl)cyclohexyl]methyl}-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G346-0056
N-(butan-2-yl)-2-(2,4-dioxo-3-{[4-(piperidine-1-carbonyl)cyclohexyl]methyl}-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl)acetamide

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

G346-0056

Molecular Formula

C25H36N4O4S (C25 H36 N4 O4 S)

Compound Name

N-(butan-2-yl)-2-(2,4-dioxo-3-{[4-(piperidine-1-carbonyl)cyclohexyl]methyl}-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl)acetamide

IUPAC name

N-(butan-2-yl)-2-(24-dioxo-3-{[4-(piperidine-1-carbonyl)cyclohexyl]methyl}-1H2H3H4H-thieno[32-d]pyrimidin-1-yl)acetamide

SMILES

CCC(C)NC(CN(c1c(C(N2CC(CC3)CCC3C(N3CCCCC3)=O)=O)scc1)C2=O)=O

InChI

InChI=1S/C25H36N4O4S/c1-3-17(2)26-21(30)16-28-20-11-14-34-22(20)24(32)29(25(28)33)15-18-7-9-19(10-8-18)23(31)27-12-5-4-6-13-27/h11,14,17-19H,3-10,12-13,15-16H2,1-2H3,(H,26,30)/t17-,18?,19?/m0/s1

InChI Key

UDWQWNDNBKCSMC-VIQWUECVSA-N

MDL Number (MFCD)

MFCD14999626

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

488.65

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.735

Distribution Coefficient, logD

3.735

Water Solubility, LogSw

-3.88

Polar Surface Area

73.310

Acid Dissociation Constant (pKa)

16.04

Base Dissociation Constant (pKb)

1.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

68.00

G346-0056 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G346-0056 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G346-0056?
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What is the minimum amount of G346-0056 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G346-0056
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G346-0056
  • 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 G346-0056 available by request