G394-1534 Screening compound: N-(4-bromo-3-methylphenyl)-4-(4-ethylpiperazin-1-yl)-5-methylthieno[2,3-d]pyrimidine-6-carboxamide

G394-1534 Screening compound: N-(4-bromo-3-methylphenyl)-4-(4-ethylpiperazin-1-yl)-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
G394-1534 Screening compound: N-(4-bromo-3-methylphenyl)-4-(4-ethylpiperazin-1-yl)-5-methylthieno[2,3-d]pyrimidine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G394-1534
N-(4-bromo-3-methylphenyl)-4-(4-ethylpiperazin-1-yl)-5-methylthieno[2,3-d]pyrimidine-6-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

G394-1534

Molecular Formula

C21H24BrN5OS (C21 H24 BrN5 OS)

Compound Name

N-(4-bromo-3-methylphenyl)-4-(4-ethylpiperazin-1-yl)-5-methylthieno[2,3-d]pyrimidine-6-carboxamide

IUPAC name

N-(4-bromo-3-methylphenyl)-4-(4-ethylpiperazin-1-yl)-5-methylthieno[23-d]pyrimidine-6-carboxamide

SMILES

CCN(CC1)CCN1c1ncnc2c1c(C)c(C(Nc(cc1)cc(C)c1Br)=O)s2

InChI

InChI=1S/C21H24BrN5OS/c1-4-26-7-9-27(10-8-26)19-17-14(3)18(29-21(17)24-12-23-19)20(28)25-15-5-6-16(22)13(2)11-15/h5-6,11-12H,4,7-10H2,1-3H3,(H,25,28)

InChI Key

DZQOHRWVABGNPE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15007483

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.910

Distribution Coefficient, logD

4.339

Water Solubility, LogSw

-4.76

Polar Surface Area

51.166

Acid Dissociation Constant (pKa)

9.05

Base Dissociation Constant (pKb)

7.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

G394-1534 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
  • Immune system
Targets:
  • Kinases
  • GPCR
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G394-1534 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G394-1534?
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What is the minimum amount of G394-1534 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G394-1534
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G394-1534
  • 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 G394-1534 available by request