K292-0943 Screening compound: 2-{[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl}-3-(3-methylbutyl)-3H,4H-thieno[3,2-d]pyrimidin-4-one

K292-0943 Screening compound: 2-{[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl}-3-(3-methylbutyl)-3H,4H-thieno[3,2-d]pyrimidin-4-one
K292-0943 Screening compound: 2-{[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl}-3-(3-methylbutyl)-3H,4H-thieno[3,2-d]pyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K292-0943
2-{[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl}-3-(3-methylbutyl)-3H,4H-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

K292-0943

Molecular Formula

C19H20N2O4S2 (C19 H20 N2 O4 S2)

Compound Name

2-{[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl}-3-(3-methylbutyl)-3H,4H-thieno[3,2-d]pyrimidin-4-one

IUPAC name

2-{[2-(34-dihydroxyphenyl)-2-oxoethyl]sulfanyl}-3-(3-methylbutyl)-3H4H-thieno[32-d]pyrimidin-4-one

SMILES

CC(C)CCN(C1=O)C(SCC(c(cc2)cc(O)c2O)=O)=Nc2c1scc2

InChI

InChI=1S/C19H20N2O4S2/c1-11(2)5-7-21-18(25)17-13(6-8-26-17)20-19(21)27-10-16(24)12-3-4-14(22)15(23)9-12/h3-4,6,8-9,11,22-23H,5,7,10H2,1-2H3

InChI Key

BBDODUJGRQYCNH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15091537

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.821

Distribution Coefficient, logD

3.639

Water Solubility, LogSw

-3.67

Polar Surface Area

73.382

Acid Dissociation Constant (pKa)

7.68

Base Dissociation Constant (pKb)

-0.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

K292-0943 in Drug Discovery

Included in Screening Libraries

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with K292-0943 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K292-0943?
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What is the minimum amount of K292-0943 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K292-0943
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K292-0943
  • 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 K292-0943 available by request