ZE09-2103 Screening compound: 1-[3-(5-methyl-2-tetrahydro-2H-pyran-4-yl-1H-imidazol-1-yl)-1-pyrrolidinyl]-2-butyn-1-one

ZE09-2103 Screening compound: 1-[3-(5-methyl-2-tetrahydro-2H-pyran-4-yl-1H-imidazol-1-yl)-1-pyrrolidinyl]-2-butyn-1-one
ZE09-2103 Screening compound: 1-[3-(5-methyl-2-tetrahydro-2H-pyran-4-yl-1H-imidazol-1-yl)-1-pyrrolidinyl]-2-butyn-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound ZE09-2103
1-[3-(5-methyl-2-tetrahydro-2H-pyran-4-yl-1H-imidazol-1-yl)-1-pyrrolidinyl]-2-butyn-1-one

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

ZE09-2103

Molecular Formula

C17H23N3O2 (C17 H23 N3 O2)

Compound Name

1-[3-(5-methyl-2-tetrahydro-2H-pyran-4-yl-1H-imidazol-1-yl)-1-pyrrolidinyl]-2-butyn-1-one

IUPAC name

1-{3-[5-methyl-2-(oxan-4-yl)-1H-imidazol-1-yl]pyrrolidin-1-yl}but-2-yn-1-one

SMILES

Cc1cnc(C2CCOCC2)n1C(CC1)CN1C(C#CC)=O

InChI

InChI=1S/C17H23N3O2/c1-3-4-16(21)19-8-5-15(12-19)20-13(2)11-18-17(20)14-6-9-22-10-7-14/h11,14-15H,5-10,12H2,1-2H3/t15-/m1/s1

InChI Key

WEHIXGZJUXSGJD-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD32262883

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

301.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.756

Distribution Coefficient, logD

-0.047

Water Solubility, LogSw

-1.62

Polar Surface Area

36.328

Acid Dissociation Constant (pKa)

23.63

Base Dissociation Constant (pKb)

9.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

64.71

ZE09-2103 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 ZE09-2103 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound ZE09-2103?
Check Price and Availability of ZE09-2103, 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 ZE09-2103 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for ZE09-2103
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for ZE09-2103
  • 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 ZE09-2103 available by request