1844-0024 Screening compound: 2-amino-4-(2,3-dimethoxyphenyl)-7-methyl-5-oxo-4H,5H-pyrano[3,2-c]pyran-3-carbonitrile

1844-0024 Screening compound: 2-amino-4-(2,3-dimethoxyphenyl)-7-methyl-5-oxo-4H,5H-pyrano[3,2-c]pyran-3-carbonitrile
1844-0024 Screening compound: 2-amino-4-(2,3-dimethoxyphenyl)-7-methyl-5-oxo-4H,5H-pyrano[3,2-c]pyran-3-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 1844-0024
2-amino-4-(2,3-dimethoxyphenyl)-7-methyl-5-oxo-4H,5H-pyrano[3,2-c]pyran-3-carbonitrile

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

1844-0024

Molecular Formula

C18H16N2O5 (C18 H16 N2 O5)

Compound Name

2-amino-4-(2,3-dimethoxyphenyl)-7-methyl-5-oxo-4H,5H-pyrano[3,2-c]pyran-3-carbonitrile

IUPAC name

2-amino-4-(23-dimethoxyphenyl)-7-methyl-5-oxo-4H5H-pyrano[32-c]pyran-3-carbonitrile

SMILES

CC(O1)=CC(OC(N)=C(C2c(cccc3OC)c3OC)C#N)=C2C1=O

InChI

InChI=1S/C18H16N2O5/c1-9-7-13-15(18(21)24-9)14(11(8-19)17(20)25-13)10-5-4-6-12(22-2)16(10)23-3/h4-7,14H,20H2,1-3H3/t14-/m1/s1

InChI Key

JWZCSXZDWNXHFR-CQSZACIVSA-N

MDL Number (MFCD)

MFCD00810253

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.34

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.683

Distribution Coefficient, logD

1.683

Water Solubility, LogSw

-2.10

Polar Surface Area

84.236

Acid Dissociation Constant (pKa)

15.04

Base Dissociation Constant (pKb)

-2.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

1844-0024 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Frequent Hitters Library (7624 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1844-0024 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1844-0024?
Check Price and Availability of 1844-0024, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 1844-0024 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1844-0024
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1844-0024
  • 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 1844-0024 available by request