3772-6673 Screening compound: 4-acetylphenyl 6-bromo-2-oxo-2H-chromene-3-carboxylate

3772-6673 Screening compound: 4-acetylphenyl 6-bromo-2-oxo-2H-chromene-3-carboxylate
3772-6673 Screening compound: 4-acetylphenyl 6-bromo-2-oxo-2H-chromene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3772-6673
4-acetylphenyl 6-bromo-2-oxo-2H-chromene-3-carboxylate

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

3772-6673

Molecular Formula

C18H11BrO5 (C18 H11 BrO5)

Compound Name

4-acetylphenyl 6-bromo-2-oxo-2H-chromene-3-carboxylate

IUPAC name

4-acetylphenyl 6-bromo-2-oxo-2H-chromene-3-carboxylate

SMILES

CC(c(cc1)ccc1OC(C1=Cc(cc(cc2)Br)c2OC1=O)=O)=O

InChI

InChI=1S/C18H11BrO5/c1-10(20)11-2-5-14(6-3-11)23-17(21)15-9-12-8-13(19)4-7-16(12)24-18(15)22/h2-9H,1H3

InChI Key

URJSJFNKBJZFTE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02251463

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.19

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.402

Distribution Coefficient, logD

3.402

Water Solubility, LogSw

-3.59

Polar Surface Area

55.365

Acid Dissociation Constant (pKa)

21.69

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

3772-6673 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 3772-6673 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3772-6673?
Check Price and Availability of 3772-6673, 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 3772-6673 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3772-6673
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3772-6673
  • 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 3772-6673 available by request