0717-0927 Screening compound: N1,N4-bis(2,4-dinitrophenyl)butane-1,4-diamine

0717-0927 Screening compound: N1,N4-bis(2,4-dinitrophenyl)butane-1,4-diamine
0717-0927 Screening compound: N1,N4-bis(2,4-dinitrophenyl)butane-1,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 0717-0927
N1,N4-bis(2,4-dinitrophenyl)butane-1,4-diamine

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

0717-0927

Molecular Formula

C16H16N6O8 (C16 H16 N6 O8)

Compound Name

N1,N4-bis(2,4-dinitrophenyl)butane-1,4-diamine

IUPAC name

N1N4-bis(24-dinitrophenyl)butane-14-diamine

SMILES

[O-][N+](c(cc1)cc([N+]([O-])=O)c1NCCCCNc(ccc([N+]([O-])=O)c1)c1[N+]([O-])=O)=O

InChI

InChI=1S/C16H16N6O8/c23-19(24)11-3-5-13(15(9-11)21(27)28)17-7-1-2-8-18-14-6-4-12(20(25)26)10-16(14)22(29)30/h3-6,9-10,17-18H,1-2,7-8H2

InChI Key

BUHLQTKCMFSECS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00343138

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.34

Hydrogen Bond Acceptors Count

16.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

14

Partition Coefficient, logP

3.755

Distribution Coefficient, logD

3.755

Water Solubility, LogSw

-4.10

Polar Surface Area

152.191

Acid Dissociation Constant (pKa)

15.03

Base Dissociation Constant (pKb)

-2.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with 0717-0927 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0717-0927?
Check Price and Availability of 0717-0927, 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 0717-0927 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0717-0927
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0717-0927
  • 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 0717-0927 available by request