3922-0031 Screening compound: N-(4,7-dimethyl-2-oxo-2H-chromen-6-yl)heptanamide

3922-0031 Screening compound: N-(4,7-dimethyl-2-oxo-2H-chromen-6-yl)heptanamide
3922-0031 Screening compound: N-(4,7-dimethyl-2-oxo-2H-chromen-6-yl)heptanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3922-0031
N-(4,7-dimethyl-2-oxo-2H-chromen-6-yl)heptanamide

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

3922-0031

Molecular Formula

C18H23NO3 (C18 H23 NO3)

Compound Name

N-(4,7-dimethyl-2-oxo-2H-chromen-6-yl)heptanamide

IUPAC name

N-(47-dimethyl-2-oxo-2H-chromen-6-yl)heptanamide

SMILES

CCCCCCC(Nc(c(C)c1)cc(C(C)=C2)c1OC2=O)=O

InChI

InChI=1S/C18H23NO3/c1-4-5-6-7-8-17(20)19-15-11-14-12(2)10-18(21)22-16(14)9-13(15)3/h9-11H,4-8H2,1-3H3,(H,19,20)

InChI Key

HELUEMOUPYFJAC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02321342

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

301.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.688

Distribution Coefficient, logD

3.688

Water Solubility, LogSw

-3.83

Polar Surface Area

43.097

Acid Dissociation Constant (pKa)

11.11

Base Dissociation Constant (pKb)

-0.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

3922-0031 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3922-0031 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3922-0031?
Check Price and Availability of 3922-0031, 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 3922-0031 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3922-0031
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3922-0031
  • 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 3922-0031 available by request