C276-0689 Screening compound: 8-(3-bromo-4-ethoxy-5-methoxyphenyl)-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinolin-6-one

C276-0689 Screening compound: 8-(3-bromo-4-ethoxy-5-methoxyphenyl)-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinolin-6-one
C276-0689 Screening compound: 8-(3-bromo-4-ethoxy-5-methoxyphenyl)-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinolin-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C276-0689
8-(3-bromo-4-ethoxy-5-methoxyphenyl)-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinolin-6-one

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

C276-0689

Molecular Formula

C19H18BrNO5 (C19 H18 BrNO5)

Compound Name

8-(3-bromo-4-ethoxy-5-methoxyphenyl)-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinolin-6-one

IUPAC name

8-(3-bromo-4-ethoxy-5-methoxyphenyl)-2H5H6H7H8H-[13]dioxolo[45-g]quinolin-6-one

SMILES

CCOc(c(OC)cc(C(C1)c(cc2OCOc2c2)c2NC1=O)c1)c1Br

InChI

InChI=1S/C19H18BrNO5/c1-3-24-19-13(20)4-10(5-17(19)23-2)11-7-18(22)21-14-8-16-15(6-12(11)14)25-9-26-16/h4-6,8,11H,3,7,9H2,1-2H3,(H,21,22)/t11-/m0/s1

InChI Key

HEMDVKGZVNSGHS-NSHDSACASA-N

MDL Number (MFCD)

MFCD06754655

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.26

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.543

Distribution Coefficient, logD

3.543

Water Solubility, LogSw

-3.64

Polar Surface Area

56.830

Acid Dissociation Constant (pKa)

11.12

Base Dissociation Constant (pKb)

-0.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.60

C276-0689 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antimitotic Tubulin Library (17355 compounds)

Human GPCR Annotated Library (5539 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C276-0689 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C276-0689?
Check Price and Availability of C276-0689, 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 C276-0689 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C276-0689
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C276-0689
  • 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 C276-0689 available by request