Y043-6616 Screening compound: 4-(3,4-dichlorophenyl)-N-{2-oxo-2-[(2-pyridylmethyl)amino]ethyl}tetrahydro-1(2H)-pyrazinecarboxamide

Y043-6616 Screening compound: 4-(3,4-dichlorophenyl)-N-{2-oxo-2-[(2-pyridylmethyl)amino]ethyl}tetrahydro-1(2H)-pyrazinecarboxamide
Y043-6616 Screening compound: 4-(3,4-dichlorophenyl)-N-{2-oxo-2-[(2-pyridylmethyl)amino]ethyl}tetrahydro-1(2H)-pyrazinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-6616
4-(3,4-dichlorophenyl)-N-{2-oxo-2-[(2-pyridylmethyl)amino]ethyl}tetrahydro-1(2H)-pyrazinecarboxamide

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

Y043-6616

Molecular Formula

C19H21Cl2N5O2 (C19 H21 Cl2 N5 O2)

Compound Name

4-(3,4-dichlorophenyl)-N-{2-oxo-2-[(2-pyridylmethyl)amino]ethyl}tetrahydro-1(2H)-pyrazinecarboxamide

IUPAC name

2-{[4-(34-dichlorophenyl)piperazine-1-carbonyl]amino}-N-[(pyridin-2-yl)methyl]acetamide

SMILES

O=C(CNC(N(CC1)CCN1c(cc1)cc(Cl)c1Cl)=O)NCc1ncccc1

InChI

InChI=1S/C19H21Cl2N5O2/c20-16-5-4-15(11-17(16)21)25-7-9-26(10-8-25)19(28)24-13-18(27)23-12-14-3-1-2-6-22-14/h1-6,11H,7-10,12-13H2,(H,23,27)(H,24,28)

InChI Key

KOUBRGWYFJHAHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20537013

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.860

Distribution Coefficient, logD

2.859

Water Solubility, LogSw

-3.36

Polar Surface Area

64.305

Acid Dissociation Constant (pKa)

13.35

Base Dissociation Constant (pKb)

4.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.58

Y043-6616 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 Y043-6616 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-6616?
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What is the minimum amount of Y043-6616 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-6616
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-6616
  • 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 Y043-6616 available by request