K305-0197 Screening compound: N,N,5-trimethyl-2,4-dioxo-3-phenyl-1-{[(2,4,6-trimethylphenyl)carbamoyl]methyl}-1H,2H,3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide

K305-0197 Screening compound: N,N,5-trimethyl-2,4-dioxo-3-phenyl-1-{[(2,4,6-trimethylphenyl)carbamoyl]methyl}-1H,2H,3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide
K305-0197 Screening compound: N,N,5-trimethyl-2,4-dioxo-3-phenyl-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 K305-0197
N,N,5-trimethyl-2,4-dioxo-3-phenyl-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

K305-0197

Molecular Formula

C27H28N4O4S (C27 H28 N4 O4 S)

Compound Name

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

IUPAC name

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

SMILES

Cc1c(C(N(C)C)=O)sc(N(CC(Nc2c(C)cc(C)cc2C)=O)C(N2c3ccccc3)=O)c1C2=O

InChI

InChI=1S/C27H28N4O4S/c1-15-12-16(2)22(17(3)13-15)28-20(32)14-30-26-21(18(4)23(36-26)25(34)29(5)6)24(33)31(27(30)35)19-10-8-7-9-11-19/h7-13H,14H2,1-6H3,(H,28,32)

InChI Key

HLMUZSAXTOZIBN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15092805

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

504.61

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.945

Distribution Coefficient, logD

2.945

Water Solubility, LogSw

-3.04

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

25.90

K305-0197 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with K305-0197 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K305-0197?
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What is the minimum amount of K305-0197 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K305-0197
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K305-0197
  • 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 K305-0197 available by request