Y043-6818 Screening compound: 4-benzyl-N-{2-[(5-isopropyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}tetrahydro-1(2H)-pyrazinecarboxamide

Y043-6818 Screening compound: 4-benzyl-N-{2-[(5-isopropyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}tetrahydro-1(2H)-pyrazinecarboxamide
Y043-6818 Screening compound: 4-benzyl-N-{2-[(5-isopropyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}tetrahydro-1(2H)-pyrazinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-6818
4-benzyl-N-{2-[(5-isopropyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}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

Y043-6818

Molecular Formula

C19H26N6O2S (C19 H26 N6 O2 S)

Compound Name

4-benzyl-N-{2-[(5-isopropyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}tetrahydro-1(2H)-pyrazinecarboxamide

IUPAC name

2-[(4-benzylpiperazine-1-carbonyl)amino]-N-[5-(propan-2-yl)-134-thiadiazol-2-yl]acetamide

SMILES

CC(C)c1nnc(NC(CNC(N2CCN(Cc3ccccc3)CC2)=O)=O)s1

InChI

InChI=1S/C19H26N6O2S/c1-14(2)17-22-23-18(28-17)21-16(26)12-20-19(27)25-10-8-24(9-11-25)13-15-6-4-3-5-7-15/h3-7,14H,8-13H2,1-2H3,(H,20,27)(H,21,23,26)

InChI Key

OFAFROYCAYORAZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD22583640

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.325

Distribution Coefficient, logD

1.803

Water Solubility, LogSw

-2.81

Polar Surface Area

77.264

Acid Dissociation Constant (pKa)

8.62

Base Dissociation Constant (pKb)

7.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.37

Y043-6818 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with Y043-6818 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-6818?
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What is the minimum amount of Y043-6818 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-6818
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-6818
  • 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 Y043-6818 available by request