Y043-6717 Screening compound: N-[(1S)-2-(cyclohexylamino)-1-methyl-2-oxoethyl]-4-phenyltetrahydro-1(2H)-pyrazinecarboxamide

Y043-6717 Screening compound: N-[(1S)-2-(cyclohexylamino)-1-methyl-2-oxoethyl]-4-phenyltetrahydro-1(2H)-pyrazinecarboxamide
Y043-6717 Screening compound: N-[(1S)-2-(cyclohexylamino)-1-methyl-2-oxoethyl]-4-phenyltetrahydro-1(2H)-pyrazinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-6717
N-[(1S)-2-(cyclohexylamino)-1-methyl-2-oxoethyl]-4-phenyltetrahydro-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

Y043-6717

Molecular Formula

C20H30N4O2 (C20 H30 N4 O2)

Compound Name

N-[(1S)-2-(cyclohexylamino)-1-methyl-2-oxoethyl]-4-phenyltetrahydro-1(2H)-pyrazinecarboxamide

IUPAC name

(2S)-N-cyclohexyl-2-[(4-phenylpiperazine-1-carbonyl)amino]propanamide

SMILES

CC(C(NC1CCCCC1)=O)NC(N(CC1)CCN1c1ccccc1)=O

InChI

InChI=1S/C20H30N4O2/c1-16(19(25)22-17-8-4-2-5-9-17)21-20(26)24-14-12-23(13-15-24)18-10-6-3-7-11-18/h3,6-7,10-11,16-17H,2,4-5,8-9,12-15H2,1H3,(H,21,26)(H,22,25)/t16-/m0/s1

InChI Key

JURMDRYNTXJTMW-INIZCTEOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.087

Distribution Coefficient, logD

3.083

Water Solubility, LogSw

-3.25

Polar Surface Area

53.863

Acid Dissociation Constant (pKa)

15.28

Base Dissociation Constant (pKb)

7.56

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.00

Y043-6717 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with Y043-6717 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-6717?
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What is the minimum amount of Y043-6717 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-6717
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-6717
  • 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 Y043-6717 available by request