K305-0178 Screening compound: 3-(4-ethylphenyl)-N,N,5-trimethyl-2,4-dioxo-1-{[(2,4,6-trimethylphenyl)carbamoyl]methyl}-1H,2H,3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide

K305-0178 Screening compound: 3-(4-ethylphenyl)-N,N,5-trimethyl-2,4-dioxo-1-{[(2,4,6-trimethylphenyl)carbamoyl]methyl}-1H,2H,3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide
K305-0178 Screening compound: 3-(4-ethylphenyl)-N,N,5-trimethyl-2,4-dioxo-1-{[(2,4,6-trimethylphenyl)carbamoyl]methyl}-1H,2H,3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K305-0178
3-(4-ethylphenyl)-N,N,5-trimethyl-2,4-dioxo-1-{[(2,4,6-trimethylphenyl)carbamoyl]methyl}-1H,2H,3H,4H-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

K305-0178

Molecular Formula

C29H32N4O4S (C29 H32 N4 O4 S)

Compound Name

3-(4-ethylphenyl)-N,N,5-trimethyl-2,4-dioxo-1-{[(2,4,6-trimethylphenyl)carbamoyl]methyl}-1H,2H,3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide

IUPAC name

3-(4-ethylphenyl)-NN5-trimethyl-24-dioxo-1-{[(246-trimethylphenyl)carbamoyl]methyl}-1H2H3H4H-thieno[23-d]pyrimidine-6-carboxamide

SMILES

CCc(cc1)ccc1N(C(c1c(N2CC(Nc3c(C)cc(C)cc3C)=O)sc(C(N(C)C)=O)c1C)=O)C2=O

InChI

InChI=1S/C29H32N4O4S/c1-8-20-9-11-21(12-10-20)33-26(35)23-19(5)25(27(36)31(6)7)38-28(23)32(29(33)37)15-22(34)30-24-17(3)13-16(2)14-18(24)4/h9-14H,8,15H2,1-7H3,(H,30,34)

InChI Key

JFCUVCDFNKQQPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15092790

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

532.66

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.997

Distribution Coefficient, logD

3.997

Water Solubility, LogSw

-4.07

Polar Surface Area

68.861

Acid Dissociation Constant (pKa)

12.42

Base Dissociation Constant (pKb)

-0.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.00

K305-0178 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with K305-0178 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K305-0178?
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What is the minimum amount of K305-0178 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K305-0178
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K305-0178
  • 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 K305-0178 available by request