V028-0831 Screening compound: 3-fluoro-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-N-(2-methylpropyl)benzamide

V028-0831 Screening compound: 3-fluoro-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-N-(2-methylpropyl)benzamide
V028-0831 Screening compound: 3-fluoro-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-N-(2-methylpropyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-0831
3-fluoro-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-N-(2-methylpropyl)benzamide

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

V028-0831

Molecular Formula

C28H32FN5O3 (C28 H32 FN5 O3)

Compound Name

3-fluoro-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-N-(2-methylpropyl)benzamide

IUPAC name

3-fluoro-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-N-(2-methylpropyl)benzamide

SMILES

CC(C)CN(CC(N(CC1)CCN1c(cc1)nnc1-c(cc1)ccc1OC)=O)C(c1cccc(F)c1)=O

InChI

InChI=1S/C28H32FN5O3/c1-20(2)18-34(28(36)22-5-4-6-23(29)17-22)19-27(35)33-15-13-32(14-16-33)26-12-11-25(30-31-26)21-7-9-24(37-3)10-8-21/h4-12,17,20H,13-16,18-19H2,1-3H3

InChI Key

MNFKNUJECNQQGX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19829873

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

505.59

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.939

Distribution Coefficient, logD

3.937

Water Solubility, LogSw

-4.06

Polar Surface Area

64.581

Acid Dissociation Constant (pKa)

22.59

Base Dissociation Constant (pKb)

5.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

V028-0831 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with V028-0831 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-0831?
Check Price and Availability of V028-0831, 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 V028-0831 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-0831
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-0831
  • 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 V028-0831 available by request