3130-1207 Screening compound: 4-chloro-2-methylphenyl 6-bromo-2-oxo-2H-chromene-3-carboxylate

3130-1207 Screening compound: 4-chloro-2-methylphenyl 6-bromo-2-oxo-2H-chromene-3-carboxylate
3130-1207 Screening compound: 4-chloro-2-methylphenyl 6-bromo-2-oxo-2H-chromene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3130-1207
4-chloro-2-methylphenyl 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

3130-1207

Molecular Formula

C17H10BrClO4 (C17 H10 BrClO4)

Compound Name

4-chloro-2-methylphenyl 6-bromo-2-oxo-2H-chromene-3-carboxylate

IUPAC name

4-chloro-2-methylphenyl 6-bromo-2-oxo-2H-chromene-3-carboxylate

SMILES

Cc(cc(cc1)Cl)c1OC(C1=Cc(cc(cc2)Br)c2OC1=O)=O

InChI

InChI=1S/C17H10BrClO4/c1-9-6-12(19)3-5-14(9)22-16(20)13-8-10-7-11(18)2-4-15(10)23-17(13)21/h2-8H,1H3

InChI Key

CAEZEQXWMCEPMR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02342979

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.62

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.121

Distribution Coefficient, logD

5.121

Water Solubility, LogSw

-5.55

Polar Surface Area

41.625

Acid Dissociation Constant (pKa)

28.41

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

3130-1207 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 3130-1207 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3130-1207?
Check Price and Availability of 3130-1207, 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 3130-1207 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3130-1207
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3130-1207
  • 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 3130-1207 available by request