3756-0006 Screening compound: 1-[4-fluoro-5-(4-methylpiperidin-1-yl)-2-nitrophenyl]-4-(2-fluorobenzoyl)piperazine

3756-0006 Screening compound: 1-[4-fluoro-5-(4-methylpiperidin-1-yl)-2-nitrophenyl]-4-(2-fluorobenzoyl)piperazine
3756-0006 Screening compound: 1-[4-fluoro-5-(4-methylpiperidin-1-yl)-2-nitrophenyl]-4-(2-fluorobenzoyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3756-0006
1-[4-fluoro-5-(4-methylpiperidin-1-yl)-2-nitrophenyl]-4-(2-fluorobenzoyl)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

3756-0006

Molecular Formula

C23H26F2N4O3 (C23 H26 F2 N4 O3)

Compound Name

1-[4-fluoro-5-(4-methylpiperidin-1-yl)-2-nitrophenyl]-4-(2-fluorobenzoyl)piperazine

IUPAC name

1-[4-fluoro-5-(4-methylpiperidin-1-yl)-2-nitrophenyl]-4-(2-fluorobenzoyl)piperazine

SMILES

CC(CC1)CCN1c(cc(c([N+]([O-])=O)c1)N(CC2)CCN2C(c(cccc2)c2F)=O)c1F

InChI

InChI=1S/C23H26F2N4O3/c1-16-6-8-26(9-7-16)20-15-21(22(29(31)32)14-19(20)25)27-10-12-28(13-11-27)23(30)17-4-2-3-5-18(17)24/h2-5,14-16H,6-13H2,1H3

InChI Key

HNJXHUAMPPNFCW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02214297

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.267

Distribution Coefficient, logD

4.267

Water Solubility, LogSw

-4.40

Polar Surface Area

56.078

Acid Dissociation Constant (pKa)

25.52

Base Dissociation Constant (pKb)

2.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

References: we are preparing a list of scientific research reports with 3756-0006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3756-0006?
Check Price and Availability of 3756-0006, 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 3756-0006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3756-0006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3756-0006
  • 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 3756-0006 available by request