D129-0033 Screening compound: 3-tert-butyl-4-methyl-9-propyl-7H-furo[2,3-f]chromen-7-one

D129-0033 Screening compound: 3-tert-butyl-4-methyl-9-propyl-7H-furo[2,3-f]chromen-7-one
D129-0033 Screening compound: 3-tert-butyl-4-methyl-9-propyl-7H-furo[2,3-f]chromen-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D129-0033
3-tert-butyl-4-methyl-9-propyl-7H-furo[2,3-f]chromen-7-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

D129-0033

Molecular Formula

C19H22O3 (C19 H22 O3)

Compound Name

3-tert-butyl-4-methyl-9-propyl-7H-furo[2,3-f]chromen-7-one

IUPAC name

3-tert-butyl-4-methyl-9-propyl-7H-furo[23-f]chromen-7-one

SMILES

CCCC(c(c(occ1C(C)(C)C)c1c(C)c1)c1O1)=CC1=O

InChI

InChI=1S/C19H22O3/c1-6-7-12-9-15(20)22-14-8-11(2)16-13(19(3,4)5)10-21-18(16)17(12)14/h8-10H,6-7H2,1-5H3

InChI Key

PKTWNKOQUNZIKA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03853648

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

298.38

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.986

Distribution Coefficient, logD

4.986

Water Solubility, LogSw

-4.95

Polar Surface Area

30.438

Acid Dissociation Constant (pKa)

27.41

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

D129-0033 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Akt-Targeted Library (14764 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D129-0033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D129-0033?
Check Price and Availability of D129-0033, 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 D129-0033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D129-0033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D129-0033
  • 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 D129-0033 available by request