V002-4617 Screening compound: N-ethyl-2-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)propanamide

V002-4617 Screening compound: N-ethyl-2-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)propanamide
V002-4617 Screening compound: N-ethyl-2-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-4617
N-ethyl-2-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)propanamide

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

V002-4617

Molecular Formula

C23H31N5O2 (C23 H31 N5 O2)

Compound Name

N-ethyl-2-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)propanamide

IUPAC name

N-ethyl-2-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)propanamide

SMILES

CCN(CC(N(CC1)CCN1c(cc1)nnc1-c1ccc(C)cc1)=O)C(C(C)C)=O

InChI

InChI=1S/C23H31N5O2/c1-5-26(23(30)17(2)3)16-22(29)28-14-12-27(13-15-28)21-11-10-20(24-25-21)19-8-6-18(4)7-9-19/h6-11,17H,5,12-16H2,1-4H3

InChI Key

UTMPGFILXWSSBC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19827628

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

409.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.077

Distribution Coefficient, logD

3.057

Water Solubility, LogSw

-2.94

Polar Surface Area

57.033

Acid Dissociation Constant (pKa)

22.33

Base Dissociation Constant (pKb)

6.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.80

V002-4617 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with V002-4617 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-4617?
Check Price and Availability of V002-4617, 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 V002-4617 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-4617
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-4617
  • 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 V002-4617 available by request