T161-0859 Screening compound: N-[2-(1-benzyl-5-methyl-1H-imidazol-2-yl)ethyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide

T161-0859 Screening compound: N-[2-(1-benzyl-5-methyl-1H-imidazol-2-yl)ethyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide
T161-0859 Screening compound: N-[2-(1-benzyl-5-methyl-1H-imidazol-2-yl)ethyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T161-0859
N-[2-(1-benzyl-5-methyl-1H-imidazol-2-yl)ethyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide

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

T161-0859

Molecular Formula

C24H27N3O2 (C24 H27 N3 O2)

Compound Name

N-[2-(1-benzyl-5-methyl-1H-imidazol-2-yl)ethyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide

IUPAC name

N-[2-(1-benzyl-5-methyl-1H-imidazol-2-yl)ethyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide

SMILES

Cc1cnc(CCNC(C2(CC2)c(cc2)ccc2OC)=O)n1Cc1ccccc1

InChI

InChI=1S/C24H27N3O2/c1-18-16-26-22(27(18)17-19-6-4-3-5-7-19)12-15-25-23(28)24(13-14-24)20-8-10-21(29-2)11-9-20/h3-11,16H,12-15,17H2,1-2H3,(H,25,28)

InChI Key

SWBPJJRDTCSSEQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31988503

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.300

Distribution Coefficient, logD

2.747

Water Solubility, LogSw

-3.24

Polar Surface Area

44.450

Acid Dissociation Constant (pKa)

13.97

Base Dissociation Constant (pKb)

7.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

T161-0859 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T161-0859 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T161-0859?
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What is the minimum amount of T161-0859 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T161-0859
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T161-0859
  • 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 T161-0859 available by request