G346-0277 Screening compound: N-butyl-4-({1-[(diethylcarbamoyl)methyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}methyl)cyclohexane-1-carboxamide

G346-0277 Screening compound: N-butyl-4-({1-[(diethylcarbamoyl)methyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}methyl)cyclohexane-1-carboxamide
G346-0277 Screening compound: N-butyl-4-({1-[(diethylcarbamoyl)methyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}methyl)cyclohexane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G346-0277
N-butyl-4-({1-[(diethylcarbamoyl)methyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}methyl)cyclohexane-1-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

G346-0277

Molecular Formula

C24H36N4O4S (C24 H36 N4 O4 S)

Compound Name

N-butyl-4-({1-[(diethylcarbamoyl)methyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}methyl)cyclohexane-1-carboxamide

IUPAC name

N-butyl-4-({1-[(diethylcarbamoyl)methyl]-24-dioxo-1H2H3H4H-thieno[32-d]pyrimidin-3-yl}methyl)cyclohexane-1-carboxamide

SMILES

CCCCNC(C1CCC(CN(C(c(scc2)c2N2CC(N(CC)CC)=O)=O)C2=O)CC1)=O

InChI

InChI=1S/C24H36N4O4S/c1-4-7-13-25-22(30)18-10-8-17(9-11-18)15-28-23(31)21-19(12-14-33-21)27(24(28)32)16-20(29)26(5-2)6-3/h12,14,17-18H,4-11,13,15-16H2,1-3H3,(H,25,30)

InChI Key

YROQGOYKLRIRRQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14999705

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.64

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.633

Distribution Coefficient, logD

3.633

Water Solubility, LogSw

-3.65

Polar Surface Area

72.680

Acid Dissociation Constant (pKa)

14.41

Base Dissociation Constant (pKb)

7.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

66.70

G346-0277 in Drug Discovery

Included in Screening Libraries

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G346-0277 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G346-0277?
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What is the minimum amount of G346-0277 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G346-0277
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G346-0277
  • 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 G346-0277 available by request