R091-0007 Screening compound: 1,4-bis(butylamino)-9,10-dihydroanthracene-9,10-dione

R091-0007 Screening compound: 1,4-bis(butylamino)-9,10-dihydroanthracene-9,10-dione
R091-0007 Screening compound: 1,4-bis(butylamino)-9,10-dihydroanthracene-9,10-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound R091-0007
1,4-bis(butylamino)-9,10-dihydroanthracene-9,10-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

R091-0007

Molecular Formula

C22H26N2O2 (C22 H26 N2 O2)

Compound Name

1,4-bis(butylamino)-9,10-dihydroanthracene-9,10-dione

IUPAC name

14-bis(butylamino)-910-dihydroanthracene-910-dione

SMILES

CCCCNc(c(C(c1c2cccc1)=O)c1C2=O)ccc1NCCCC

InChI

InChI=1S/C22H26N2O2/c1-3-5-13-23-17-11-12-18(24-14-6-4-2)20-19(17)21(25)15-9-7-8-10-16(15)22(20)26/h7-12,23-24H,3-6,13-14H2,1-2H3

InChI Key

OCQDPIXQTSYZJL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00011714

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.114

Distribution Coefficient, logD

6.114

Water Solubility, LogSw

-5.58

Polar Surface Area

45.480

Acid Dissociation Constant (pKa)

19.24

Base Dissociation Constant (pKb)

-0.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

References: we are preparing a list of scientific research reports with R091-0007 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound R091-0007?
Check Price and Availability of R091-0007, 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 R091-0007 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for R091-0007
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for R091-0007
  • 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 R091-0007 available by request