3993-2687 Screening compound: 7-({5,6-dimethylthieno[2,3-d]pyrimidin-4-yl}oxy)-4-methyl-2H-chromen-2-one

3993-2687 Screening compound: 7-({5,6-dimethylthieno[2,3-d]pyrimidin-4-yl}oxy)-4-methyl-2H-chromen-2-one
3993-2687 Screening compound: 7-({5,6-dimethylthieno[2,3-d]pyrimidin-4-yl}oxy)-4-methyl-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3993-2687
7-({5,6-dimethylthieno[2,3-d]pyrimidin-4-yl}oxy)-4-methyl-2H-chromen-2-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

3993-2687

Molecular Formula

C18H14N2O3S (C18 H14 N2 O3 S)

Compound Name

7-({5,6-dimethylthieno[2,3-d]pyrimidin-4-yl}oxy)-4-methyl-2H-chromen-2-one

IUPAC name

7-({56-dimethylthieno[23-d]pyrimidin-4-yl}oxy)-4-methyl-2H-chromen-2-one

SMILES

Cc1c(C)sc2ncnc(Oc(cc3)cc(O4)c3C(C)=CC4=O)c12

InChI

InChI=1S/C18H14N2O3S/c1-9-6-15(21)23-14-7-12(4-5-13(9)14)22-17-16-10(2)11(3)24-18(16)20-8-19-17/h4-8H,1-3H3

InChI Key

DFMMBCDBJQOWPR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02324385

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.053

Distribution Coefficient, logD

4.053

Water Solubility, LogSw

-4.45

Polar Surface Area

49.066

Acid Dissociation Constant (pKa)

28.02

Base Dissociation Constant (pKb)

2.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

3993-2687 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 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 3993-2687 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3993-2687?
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What is the minimum amount of 3993-2687 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3993-2687
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3993-2687
  • 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 3993-2687 available by request