K979-0023 Screening compound: N-{[(3,4-dimethoxyphenyl)carbamoyl]methyl}-2-{6-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamide

K979-0023 Screening compound: N-{[(3,4-dimethoxyphenyl)carbamoyl]methyl}-2-{6-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamide
K979-0023 Screening compound: N-{[(3,4-dimethoxyphenyl)carbamoyl]methyl}-2-{6-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K979-0023
N-{[(3,4-dimethoxyphenyl)carbamoyl]methyl}-2-{6-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamide

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

K979-0023

Molecular Formula

C19H20N4O5S (C19 H20 N4 O5 S)

Compound Name

N-{[(3,4-dimethoxyphenyl)carbamoyl]methyl}-2-{6-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamide

IUPAC name

N-{[(34-dimethoxyphenyl)carbamoyl]methyl}-2-{6-methyl-4-oxo-3H4H-thieno[23-d]pyrimidin-3-yl}acetamide

SMILES

Cc1cc(C(N(CC(NCC(Nc(cc2)cc(OC)c2OC)=O)=O)C=N2)=O)c2s1

InChI

InChI=1S/C19H20N4O5S/c1-11-6-13-18(29-11)21-10-23(19(13)26)9-17(25)20-8-16(24)22-12-4-5-14(27-2)15(7-12)28-3/h4-7,10H,8-9H2,1-3H3,(H,20,25)(H,22,24)

InChI Key

IPOJKALNUSOQDV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15115759

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.46

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.522

Distribution Coefficient, logD

1.522

Water Solubility, LogSw

-2.65

Polar Surface Area

89.123

Acid Dissociation Constant (pKa)

11.51

Base Dissociation Constant (pKb)

2.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

K979-0023 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with K979-0023 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K979-0023?
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What is the minimum amount of K979-0023 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K979-0023
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K979-0023
  • 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 K979-0023 available by request