ZE09-2003 Screening compound: N-[1-(2-chloropropanoyl)-3-azetanyl]-N-tetrahydro-2H-pyran-4-ylmethanesulfonamide

ZE09-2003 Screening compound: N-[1-(2-chloropropanoyl)-3-azetanyl]-N-tetrahydro-2H-pyran-4-ylmethanesulfonamide
ZE09-2003 Screening compound: N-[1-(2-chloropropanoyl)-3-azetanyl]-N-tetrahydro-2H-pyran-4-ylmethanesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound ZE09-2003
N-[1-(2-chloropropanoyl)-3-azetanyl]-N-tetrahydro-2H-pyran-4-ylmethanesulfonamide

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

ZE09-2003

Molecular Formula

C12H21ClN2O4S (C12 H21 ClN2 O4 S)

Compound Name

N-[1-(2-chloropropanoyl)-3-azetanyl]-N-tetrahydro-2H-pyran-4-ylmethanesulfonamide

IUPAC name

N-[1-(2-chloropropanoyl)azetidin-3-yl]-N-(oxan-4-yl)methanesulfonamide

SMILES

CC(C(N(C1)CC1N(C1CCOCC1)S(C)(=O)=O)=O)Cl

InChI

InChI=1S/C12H21ClN2O4S/c1-9(13)12(16)14-7-11(8-14)15(20(2,17)18)10-3-5-19-6-4-10/h9-11H,3-8H2,1-2H3/t9-/m0/s1

InChI Key

LUBCCZJLJWIJKX-VIFPVBQESA-N

MDL Number (MFCD)

MFCD32262860

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.83

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.364

Distribution Coefficient, logD

0.364

Water Solubility, LogSw

-1.34

Polar Surface Area

56.615

Acid Dissociation Constant (pKa)

19.02

Base Dissociation Constant (pKb)

-1.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

91.67

ZE09-2003 in Drug Discovery

Included in Screening Libraries

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

CORONAVIRUS Library (20774 compounds)

Covalent Fragments Smart Library (839 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with ZE09-2003 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound ZE09-2003?
Check Price and Availability of ZE09-2003, 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 ZE09-2003 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for ZE09-2003
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for ZE09-2003
  • 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 ZE09-2003 available by request