4938-0610 Screening compound: 8-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-6,10-dioxaspiro[4.5]decane-7,9-dione

4938-0610 Screening compound: 8-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-6,10-dioxaspiro[4.5]decane-7,9-dione
4938-0610 Screening compound: 8-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-6,10-dioxaspiro[4.5]decane-7,9-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 4938-0610
8-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-6,10-dioxaspiro[4.5]decane-7,9-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

4938-0610

Molecular Formula

C17H17BrO6 (C17 H17 BrO6)

Compound Name

8-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-6,10-dioxaspiro[4.5]decane-7,9-dione

IUPAC name

8-[(5-bromo-24-dimethoxyphenyl)methylidene]-610-dioxaspiro[4.5]decane-79-dione

SMILES

COc(c(C=C(C(OC1(CCCC1)O1)=O)C1=O)c1)cc(OC)c1Br

InChI

InChI=1S/C17H17BrO6/c1-21-13-9-14(22-2)12(18)8-10(13)7-11-15(19)23-17(24-16(11)20)5-3-4-6-17/h7-9H,3-6H2,1-2H3

InChI Key

PATHEDZKIJEJPR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01970796

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.22

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.184

Distribution Coefficient, logD

3.184

Water Solubility, LogSw

-3.46

Polar Surface Area

55.956

Acid Dissociation Constant (pKa)

27.93

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

References: we are preparing a list of scientific research reports with 4938-0610 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4938-0610?
Check Price and Availability of 4938-0610, 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 4938-0610 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4938-0610
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4938-0610
  • 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 4938-0610 available by request