1636-0268 Screening compound: 6-bromo-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide

1636-0268 Screening compound: 6-bromo-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide
1636-0268 Screening compound: 6-bromo-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1636-0268
6-bromo-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide

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

1636-0268

Molecular Formula

C17H12BrNO3 (C17 H12 BrNO3)

Compound Name

6-bromo-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide

IUPAC name

6-bromo-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide

SMILES

Cc(cc1)ccc1NC(C1=Cc(cc(cc2)Br)c2OC1=O)=O

InChI

InChI=1S/C17H12BrNO3/c1-10-2-5-13(6-3-10)19-16(20)14-9-11-8-12(18)4-7-15(11)22-17(14)21/h2-9H,1H3,(H,19,20)

InChI Key

KAISEMJFKWORPO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00811791

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.19

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.040

Distribution Coefficient, logD

4.039

Water Solubility, LogSw

-4.24

Polar Surface Area

44.251

Acid Dissociation Constant (pKa)

9.78

Base Dissociation Constant (pKb)

-0.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

1636-0268 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Frequent Hitters Library (7624 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Structure:
  • Pool
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 1636-0268 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1636-0268?
Check Price and Availability of 1636-0268, 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 1636-0268 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1636-0268
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1636-0268
  • 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 1636-0268 available by request