G394-0280 Screening compound: N-{3-[(butan-2-yl)[(furan-2-yl)methyl]amino]propyl}-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide

G394-0280 Screening compound: N-{3-[(butan-2-yl)[(furan-2-yl)methyl]amino]propyl}-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
G394-0280 Screening compound: N-{3-[(butan-2-yl)[(furan-2-yl)methyl]amino]propyl}-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G394-0280
N-{3-[(butan-2-yl)[(furan-2-yl)methyl]amino]propyl}-5-methyl-4-(4-methylpiperazin-1-yl)thieno[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

G394-0280

Molecular Formula

C25H36N6O2S (C25 H36 N6 O2 S)

Compound Name

N-{3-[(butan-2-yl)[(furan-2-yl)methyl]amino]propyl}-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide

IUPAC name

N-{3-[(butan-2-yl)[(furan-2-yl)methyl]amino]propyl}-5-methyl-4-(4-methylpiperazin-1-yl)thieno[23-d]pyrimidine-6-carboxamide

SMILES

CCC(C)N(CCCNC(c1c(C)c2c(N3CCN(C)CC3)ncnc2s1)=O)Cc1ccco1

InChI

InChI=1S/C25H36N6O2S/c1-5-18(2)31(16-20-8-6-15-33-20)10-7-9-26-24(32)22-19(3)21-23(27-17-28-25(21)34-22)30-13-11-29(4)12-14-30/h6,8,15,17-18H,5,7,9-14,16H2,1-4H3,(H,26,32)/t18-/m0/s1

InChI Key

JTIKKSLHQFVLAD-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27138548

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484.67

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.794

Distribution Coefficient, logD

2.328

Water Solubility, LogSw

-3.98

Polar Surface Area

63.200

Acid Dissociation Constant (pKa)

13.67

Base Dissociation Constant (pKb)

8.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

56.00

G394-0280 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Akt-Targeted Library (14764 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • GPCR
  • Kinases
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G394-0280 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G394-0280?
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What is the minimum amount of G394-0280 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G394-0280
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G394-0280
  • 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 G394-0280 available by request