Y043-3222 Screening compound: 2-(1-azepanylmethyl)-6-(1-naphthyl)-3(2H)-pyridazinone

Y043-3222 Screening compound: 2-(1-azepanylmethyl)-6-(1-naphthyl)-3(2H)-pyridazinone
Y043-3222 Screening compound: 2-(1-azepanylmethyl)-6-(1-naphthyl)-3(2H)-pyridazinone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-3222
2-(1-azepanylmethyl)-6-(1-naphthyl)-3(2H)-pyridazinone

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

Y043-3222

Molecular Formula

C21H23N3O (C21 H23 N3 O)

Compound Name

2-(1-azepanylmethyl)-6-(1-naphthyl)-3(2H)-pyridazinone

IUPAC name

2-[(azepan-1-yl)methyl]-6-(naphthalen-1-yl)-23-dihydropyridazin-3-one

SMILES

O=C(C=C1)N(CN2CCCCCC2)N=C1c1cccc2ccccc12

InChI

InChI=1S/C21H23N3O/c25-21-13-12-20(19-11-7-9-17-8-3-4-10-18(17)19)22-24(21)16-23-14-5-1-2-6-15-23/h3-4,7-13H,1-2,5-6,14-16H2

InChI Key

SSYSNDPVROEECT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD22582562

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.117

Distribution Coefficient, logD

3.879

Water Solubility, LogSw

-4.26

Polar Surface Area

34.033

Acid Dissociation Constant (pKa)

27.45

Base Dissociation Constant (pKb)

7.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

Y043-3222 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system

References: we are preparing a list of scientific research reports with Y043-3222 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-3222?
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What is the minimum amount of Y043-3222 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-3222
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-3222
  • 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 Y043-3222 available by request