3342-3021 Screening compound: (3Z)-3-{[(2,4-dimethoxyphenyl)amino]methylidene}-6-methyl-3,4-dihydro-2H-pyran-2,4-dione

3342-3021 Screening compound: (3Z)-3-{[(2,4-dimethoxyphenyl)amino]methylidene}-6-methyl-3,4-dihydro-2H-pyran-2,4-dione
3342-3021 Screening compound: (3Z)-3-{[(2,4-dimethoxyphenyl)amino]methylidene}-6-methyl-3,4-dihydro-2H-pyran-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3342-3021
(3Z)-3-{[(2,4-dimethoxyphenyl)amino]methylidene}-6-methyl-3,4-dihydro-2H-pyran-2,4-dione

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

3342-3021

Molecular Formula

C15H15NO5 (C15 H15 NO5)

Compound Name

(3Z)-3-{[(2,4-dimethoxyphenyl)amino]methylidene}-6-methyl-3,4-dihydro-2H-pyran-2,4-dione

IUPAC name

(3Z)-3-{[(24-dimethoxyphenyl)amino]methylidene}-6-methyl-34-dihydro-2H-pyran-24-dione

SMILES

CC(OC(/C1=C\Nc(ccc(OC)c2)c2OC)=O)=CC1=O

InChI

InChI=1S/C15H15NO5/c1-9-6-13(17)11(15(18)21-9)8-16-12-5-4-10(19-2)7-14(12)20-3/h4-8,16H,1-3H3

InChI Key

FVMURDPDYXOPQG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02328373

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

289.29

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.687

Distribution Coefficient, logD

1.178

Water Solubility, LogSw

-2.06

Polar Surface Area

62.019

Acid Dissociation Constant (pKa)

7.05

Base Dissociation Constant (pKb)

4.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

3342-3021 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with 3342-3021 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3342-3021?
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What is the minimum amount of 3342-3021 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3342-3021
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3342-3021
  • 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 3342-3021 available by request