C276-1521 Screening compound: 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-7-(4-methoxyphenyl)-1,2,3,4,5,6,7,8-octahydroquinoline-2,5-dione

C276-1521 Screening compound: 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-7-(4-methoxyphenyl)-1,2,3,4,5,6,7,8-octahydroquinoline-2,5-dione
C276-1521 Screening compound: 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-7-(4-methoxyphenyl)-1,2,3,4,5,6,7,8-octahydroquinoline-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C276-1521
4-(3-bromo-4-hydroxy-5-methoxyphenyl)-7-(4-methoxyphenyl)-1,2,3,4,5,6,7,8-octahydroquinoline-2,5-dione

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

C276-1521

Molecular Formula

C23H22BrNO5 (C23 H22 BrNO5)

Compound Name

4-(3-bromo-4-hydroxy-5-methoxyphenyl)-7-(4-methoxyphenyl)-1,2,3,4,5,6,7,8-octahydroquinoline-2,5-dione

IUPAC name

4-(3-bromo-4-hydroxy-5-methoxyphenyl)-7-(4-methoxyphenyl)-12345678-octahydroquinoline-25-dione

SMILES

COc1ccc(C(C2)CC(NC(CC3c(cc4OC)cc(Br)c4O)=O)=C3C2=O)cc1

InChI

InChI=1S/C23H22BrNO5/c1-29-15-5-3-12(4-6-15)13-8-18-22(19(26)9-13)16(11-21(27)25-18)14-7-17(24)23(28)20(10-14)30-2/h3-7,10,13,16,28H,8-9,11H2,1-2H3,(H,25,27)

InChI Key

UAVIKYRNXPTPOK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07613392

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.34

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.519

Distribution Coefficient, logD

2.256

Water Solubility, LogSw

-3.58

Polar Surface Area

68.388

Acid Dissociation Constant (pKa)

6.16

Base Dissociation Constant (pKb)

-0.95

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

30.40

C276-1521 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Akt-Targeted Library (14764 compounds)

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C276-1521 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C276-1521?
Check Price and Availability of C276-1521, 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 C276-1521 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C276-1521
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C276-1521
  • 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 C276-1521 available by request