4986-0753 Screening compound: 6,7-dibutoxy-1H,2H,3H,4H-cyclopenta[c]chromen-4-one

4986-0753 Screening compound: 6,7-dibutoxy-1H,2H,3H,4H-cyclopenta[c]chromen-4-one
4986-0753 Screening compound: 6,7-dibutoxy-1H,2H,3H,4H-cyclopenta[c]chromen-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4986-0753
6,7-dibutoxy-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

4986-0753

Molecular Formula

C20H26O4 (C20 H26 O4)

Compound Name

6,7-dibutoxy-1H,2H,3H,4H-cyclopenta[c]chromen-4-one

IUPAC name

67-dibutoxy-1H2H3H4H-cyclopenta[c]chromen-4-one

SMILES

CCCCOc1ccc(C(CCC2)=C2C(O2)=O)c2c1OCCCC

InChI

InChI=1S/C20H26O4/c1-3-5-12-22-17-11-10-15-14-8-7-9-16(14)20(21)24-18(15)19(17)23-13-6-4-2/h10-11H,3-9,12-13H2,1-2H3

InChI Key

GXXNBVMHVBIBPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02081007

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.364

Distribution Coefficient, logD

5.364

Water Solubility, LogSw

-5.40

Polar Surface Area

36.226

Acid Dissociation Constant (pKa)

24.14

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.00

References: we are preparing a list of scientific research reports with 4986-0753 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4986-0753?
Check Price and Availability of 4986-0753, 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 4986-0753 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4986-0753
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4986-0753
  • 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 4986-0753 available by request