Y040-8413 Screening compound: 6-[2-({4-methyl-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-3-yl}oxy)acetamido]hexanoic acid

Y040-8413 Screening compound: 6-[2-({4-methyl-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-3-yl}oxy)acetamido]hexanoic acid
Y040-8413 Screening compound: 6-[2-({4-methyl-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-3-yl}oxy)acetamido]hexanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-8413
6-[2-({4-methyl-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-3-yl}oxy)acetamido]hexanoic acid

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

Y040-8413

Molecular Formula

C22H27NO6 (C22 H27 NO6)

Compound Name

6-[2-({4-methyl-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-3-yl}oxy)acetamido]hexanoic acid

IUPAC name

6-[2-({4-methyl-6-oxo-6H7H8H9H10H-cyclohexa[c]chromen-3-yl}oxy)acetamido]hexanoic acid

SMILES

Cc(c(O1)c(cc2)C(CCCC3)=C3C1=O)c2OCC(NCCCCCC(O)=O)=O

InChI

InChI=1S/C22H27NO6/c1-14-18(28-13-19(24)23-12-6-2-3-9-20(25)26)11-10-16-15-7-4-5-8-17(15)22(27)29-21(14)16/h10-11H,2-9,12-13H2,1H3,(H,23,24)(H,25,26)

InChI Key

LDGUFQFNOXIMIF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03659967

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.46

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.547

Distribution Coefficient, logD

-0.281

Water Solubility, LogSw

-3.00

Polar Surface Area

81.048

Acid Dissociation Constant (pKa)

4.57

Base Dissociation Constant (pKb)

-0.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with Y040-8413 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-8413?
Check Price and Availability of Y040-8413, 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 Y040-8413 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-8413
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-8413
  • 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 Y040-8413 available by request