G346-0471 Screening compound: 2-(3-{[4-(azepane-1-carbonyl)cyclohexyl]methyl}-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl)-N-propylacetamide

G346-0471 Screening compound: 2-(3-{[4-(azepane-1-carbonyl)cyclohexyl]methyl}-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl)-N-propylacetamide
G346-0471 Screening compound: 2-(3-{[4-(azepane-1-carbonyl)cyclohexyl]methyl}-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl)-N-propylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G346-0471
2-(3-{[4-(azepane-1-carbonyl)cyclohexyl]methyl}-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl)-N-propylacetamide

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

G346-0471

Molecular Formula

C25H36N4O4S (C25 H36 N4 O4 S)

Compound Name

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

IUPAC name

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

SMILES

CCCNC(CN(c1c(C(N2CC(CC3)CCC3C(N3CCCCCC3)=O)=O)scc1)C2=O)=O

InChI

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

InChI Key

MOWVGNSVAUMXKY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14999768

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

3.826

Distribution Coefficient, logD

3.826

Water Solubility, LogSw

-3.72

Polar Surface Area

74.041

Acid Dissociation Constant (pKa)

15.82

Base Dissociation Constant (pKb)

5.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

68.00

References: we are preparing a list of scientific research reports with G346-0471 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G346-0471?
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What is the minimum amount of G346-0471 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G346-0471
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G346-0471
  • 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 G346-0471 available by request