4973-0739 Screening compound: 6-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-1H,2H,3H,4H-cyclopenta[c]chromen-4-one

4973-0739 Screening compound: 6-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-1H,2H,3H,4H-cyclopenta[c]chromen-4-one
4973-0739 Screening compound: 6-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-1H,2H,3H,4H-cyclopenta[c]chromen-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4973-0739
6-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-1H,2H,3H,4H-cyclopenta[c]chromen-4-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

4973-0739

Molecular Formula

C17H18O3 (C17 H18 O3)

Compound Name

6-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-1H,2H,3H,4H-cyclopenta[c]chromen-4-one

IUPAC name

6-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-1H2H3H4H-cyclopenta[c]chromen-4-one

SMILES

CC(COc(cc1)c(C)c(O2)c1C(CCC1)=C1C2=O)=C

InChI

InChI=1S/C17H18O3/c1-10(2)9-19-15-8-7-13-12-5-4-6-14(12)17(18)20-16(13)11(15)3/h7-8H,1,4-6,9H2,2-3H3

InChI Key

PMIKKJJIKULHIR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02059022

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

270.33

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

3.997

Distribution Coefficient, logD

3.997

Water Solubility, LogSw

-4.26

Polar Surface Area

28.717

Acid Dissociation Constant (pKa)

24.14

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

4973-0739 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 4973-0739 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4973-0739?
Check Price and Availability of 4973-0739, 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 4973-0739 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4973-0739
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4973-0739
  • 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 4973-0739 available by request