8007-2656 Screening compound: 2-{4-[3-({2-[4-(tert-butyl)phenoxy]ethyl}amino)-4-nitrophenyl]piperazino}-1-ethanol

8007-2656 Screening compound: 2-{4-[3-({2-[4-(tert-butyl)phenoxy]ethyl}amino)-4-nitrophenyl]piperazino}-1-ethanol
8007-2656 Screening compound: 2-{4-[3-({2-[4-(tert-butyl)phenoxy]ethyl}amino)-4-nitrophenyl]piperazino}-1-ethanol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-2656
2-{4-[3-({2-[4-(tert-butyl)phenoxy]ethyl}amino)-4-nitrophenyl]piperazino}-1-ethanol

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

8007-2656

Molecular Formula

C24H34N4O4 (C24 H34 N4 O4)

Compound Name

2-{4-[3-({2-[4-(tert-butyl)phenoxy]ethyl}amino)-4-nitrophenyl]piperazino}-1-ethanol

IUPAC name

2-[4-(3-{[2-(4-tert-butylphenoxy)ethyl]amino}-4-nitrophenyl)piperazin-1-yl]ethan-1-ol

SMILES

CC(C)(C)c(cc1)ccc1OCCNc(cc(cc1)N2CCN(CCO)CC2)c1[N+]([O-])=O

InChI

InChI=1S/C24H34N4O4/c1-24(2,3)19-4-7-21(8-5-19)32-17-10-25-22-18-20(6-9-23(22)28(30)31)27-13-11-26(12-14-27)15-16-29/h4-9,18,25,29H,10-17H2,1-3H3

InChI Key

MMOURLJWVGYGSS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01072884

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.921

Distribution Coefficient, logD

4.760

Water Solubility, LogSw

-4.54

Polar Surface Area

74.013

Acid Dissociation Constant (pKa)

14.97

Base Dissociation Constant (pKb)

7.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

8007-2656 in Drug Discovery

Included in Screening Libraries

Opportunistic Pathogens of Immunocompromised Hosts Annotated Library (1773 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8007-2656 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-2656?
Check Price and Availability of 8007-2656, 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 8007-2656 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-2656
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-2656
  • 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 8007-2656 available by request