Z601-1312 Screening compound: N~1~-(cyanomethyl)-N~1~-methyl-2-[4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl]acetamide

Z601-1312 Screening compound: N~1~-(cyanomethyl)-N~1~-methyl-2-[4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl]acetamide
Z601-1312 Screening compound: N~1~-(cyanomethyl)-N~1~-methyl-2-[4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Z601-1312
N~1~-(cyanomethyl)-N~1~-methyl-2-[4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl]acetamide

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

Z601-1312

Molecular Formula

C16H14N4O2 (C16 H14 N4 O2)

Compound Name

N~1~-(cyanomethyl)-N~1~-methyl-2-[4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl]acetamide

IUPAC name

N-(cyanomethyl)-N-methyl-2-{4-oxo-4H5H-pyrrolo[12-a]quinoxalin-5-yl}acetamide

SMILES

CN(CC#N)C(CN(c(cccc1)c1-n1c2ccc1)C2=O)=O

InChI

InChI=1S/C16H14N4O2/c1-18(10-8-17)15(21)11-20-13-6-3-2-5-12(13)19-9-4-7-14(19)16(20)22/h2-7,9H,10-11H2,1H3

InChI Key

OIKTWKYECLDZFI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27639395

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

294.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.126

Distribution Coefficient, logD

1.126

Water Solubility, LogSw

-1.82

Polar Surface Area

50.602

Acid Dissociation Constant (pKa)

21.55

Base Dissociation Constant (pKb)

-4.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.75

Z601-1312 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Fragments Library (11262 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with Z601-1312 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Z601-1312?
Check Price and Availability of Z601-1312, 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 Z601-1312 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Z601-1312
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Z601-1312
  • 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 Z601-1312 available by request