T161-0797 Screening compound: N-[2-(1-benzyl-5-methyl-1H-imidazol-2-yl)ethyl]-3-methylbutanamide

T161-0797 Screening compound: N-[2-(1-benzyl-5-methyl-1H-imidazol-2-yl)ethyl]-3-methylbutanamide
T161-0797 Screening compound: N-[2-(1-benzyl-5-methyl-1H-imidazol-2-yl)ethyl]-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T161-0797
N-[2-(1-benzyl-5-methyl-1H-imidazol-2-yl)ethyl]-3-methylbutanamide

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

T161-0797

Molecular Formula

C18H25N3O (C18 H25 N3 O)

Compound Name

N-[2-(1-benzyl-5-methyl-1H-imidazol-2-yl)ethyl]-3-methylbutanamide

IUPAC name

N-[2-(1-benzyl-5-methyl-1H-imidazol-2-yl)ethyl]-3-methylbutanamide

SMILES

CC(C)CC(NCCc1ncc(C)n1Cc1ccccc1)=O

InChI

InChI=1S/C18H25N3O/c1-14(2)11-18(22)19-10-9-17-20-12-15(3)21(17)13-16-7-5-4-6-8-16/h4-8,12,14H,9-11,13H2,1-3H3,(H,19,22)

InChI Key

HISFBQMGRHRREG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31989193

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

299.42

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.480

Distribution Coefficient, logD

1.927

Water Solubility, LogSw

-2.57

Polar Surface Area

36.712

Acid Dissociation Constant (pKa)

14.46

Base Dissociation Constant (pKb)

7.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.44

T161-0797 in Drug Discovery

Included in Screening Libraries

ACE2 Library (3043 compounds)

CNS BBB Library (22607 compounds)

CORONAVIRUS Library (20774 compounds)

Protein-Protein Interaction Library (218420 compounds)

Anti-HIV1 Library (19540 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with T161-0797 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T161-0797?
Check Price and Availability of T161-0797, 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 T161-0797 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T161-0797
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T161-0797
  • 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 T161-0797 available by request