C280-1030 Screening compound: 6-methyl-3-(4-methylphenyl)-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-4-one

C280-1030 Screening compound: 6-methyl-3-(4-methylphenyl)-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-4-one
C280-1030 Screening compound: 6-methyl-3-(4-methylphenyl)-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C280-1030
6-methyl-3-(4-methylphenyl)-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-4-one

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

C280-1030

Molecular Formula

C26H28N4O2S2 (C26 H28 N4 O2 S2)

Compound Name

6-methyl-3-(4-methylphenyl)-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-4-one

IUPAC name

6-methyl-3-(4-methylphenyl)-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-3H4H6H7H-thieno[32-d]pyrimidin-4-one

SMILES

CC(C1)SC(C(N2c3ccc(C)cc3)=O)=C1N=C2SCC(N(CC1)CCN1c1ccccc1)=O

InChI

InChI=1S/C26H28N4O2S2/c1-18-8-10-21(11-9-18)30-25(32)24-22(16-19(2)34-24)27-26(30)33-17-23(31)29-14-12-28(13-15-29)20-6-4-3-5-7-20/h3-11,19H,12-17H2,1-2H3/t19-/m0/s1

InChI Key

HPSSTNAXXQUBMR-IBGZPJMESA-N

MDL Number (MFCD)

MFCD04997218

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.67

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.987

Distribution Coefficient, logD

3.987

Water Solubility, LogSw

-3.94

Polar Surface Area

45.149

Acid Dissociation Constant (pKa)

27.93

Base Dissociation Constant (pKb)

3.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.60

C280-1030 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

MCL1 Targeted Library (12200 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C280-1030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C280-1030?
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What is the minimum amount of C280-1030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C280-1030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C280-1030
  • 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 C280-1030 available by request