8013-4841 Screening compound: 1-[(4-chlorophenyl)sulfonyl]-4-(4-nitro-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino}phenyl)piperazine

8013-4841 Screening compound: 1-[(4-chlorophenyl)sulfonyl]-4-(4-nitro-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino}phenyl)piperazine
8013-4841 Screening compound: 1-[(4-chlorophenyl)sulfonyl]-4-(4-nitro-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino}phenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-4841
1-[(4-chlorophenyl)sulfonyl]-4-(4-nitro-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino}phenyl)piperazine

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

8013-4841

Molecular Formula

C27H26ClF3N6O6S (C27 H26 ClF3 N6 O6 S)

Compound Name

1-[(4-chlorophenyl)sulfonyl]-4-(4-nitro-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino}phenyl)piperazine

IUPAC name

1-{5-[4-(4-chlorobenzenesulfonyl)piperazin-1-yl]-2-nitrophenyl}-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine

SMILES

[O-][N+](c(ccc(N(CC1)CCN1S(c(cc1)ccc1Cl)(=O)=O)c1)c1N(CC1)CCN1c(ccc(C(F)(F)F)c1)c1[N+]([O-])=O)=O

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

655.05

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

5.939

Distribution Coefficient, logD

5.939

Water Solubility, LogSw

-6.50

Polar Surface Area

107.482

Acid Dissociation Constant (pKa)

27.94

Base Dissociation Constant (pKb)

0.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

References: we are preparing a list of scientific research reports with 8013-4841 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-4841?
Check Price and Availability of 8013-4841, 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 8013-4841 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-4841
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-4841
  • 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 8013-4841 available by request