8016-8868 Screening compound: ethyl 3-{2-[5-(2-chlorophenyl)-2H-1,2,3,4-tetrazol-2-yl]acetamido}-3-(4-methoxyphenyl)propanoate

8016-8868 Screening compound: ethyl 3-{2-[5-(2-chlorophenyl)-2H-1,2,3,4-tetrazol-2-yl]acetamido}-3-(4-methoxyphenyl)propanoate
8016-8868 Screening compound: ethyl 3-{2-[5-(2-chlorophenyl)-2H-1,2,3,4-tetrazol-2-yl]acetamido}-3-(4-methoxyphenyl)propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-8868
ethyl 3-{2-[5-(2-chlorophenyl)-2H-1,2,3,4-tetrazol-2-yl]acetamido}-3-(4-methoxyphenyl)propanoate

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

8016-8868

Molecular Formula

C21H22ClN5O4 (C21 H22 ClN5 O4)

Compound Name

ethyl 3-{2-[5-(2-chlorophenyl)-2H-1,2,3,4-tetrazol-2-yl]acetamido}-3-(4-methoxyphenyl)propanoate

IUPAC name

ethyl 3-{2-[5-(2-chlorophenyl)-2H-1234-tetrazol-2-yl]acetamido}-3-(4-methoxyphenyl)propanoate

SMILES

CCOC(CC(c(cc1)ccc1OC)NC(Cn1nnc(-c(cccc2)c2Cl)n1)=O)=O

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.89

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.152

Distribution Coefficient, logD

3.152

Water Solubility, LogSw

-3.70

Polar Surface Area

90.146

Acid Dissociation Constant (pKa)

14.48

Base Dissociation Constant (pKb)

-1.91

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.57

8016-8868 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Antiviral Annotated Library (21441 compounds)

CNS targets activity set (6557 compounds)

Integrin Receptors Targeted library (1715 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
Agro:
  • Agro
Targets:
  • Others

References: we are preparing a list of scientific research reports with 8016-8868 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-8868?
Check Price and Availability of 8016-8868, 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 8016-8868 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-8868
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-8868
  • 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 8016-8868 available by request