E475-1033 Screening compound: 1-[3-(4-methylphenyl)-5H,6H,7H,8H,9H-imidazo[1,5-a]azepine-1-carbonyl]-1,2,3,4-tetrahydroquinoline

E475-1033 Screening compound: 1-[3-(4-methylphenyl)-5H,6H,7H,8H,9H-imidazo[1,5-a]azepine-1-carbonyl]-1,2,3,4-tetrahydroquinoline
E475-1033 Screening compound: 1-[3-(4-methylphenyl)-5H,6H,7H,8H,9H-imidazo[1,5-a]azepine-1-carbonyl]-1,2,3,4-tetrahydroquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound E475-1033
1-[3-(4-methylphenyl)-5H,6H,7H,8H,9H-imidazo[1,5-a]azepine-1-carbonyl]-1,2,3,4-tetrahydroquinoline

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

E475-1033

Molecular Formula

C25H27N3O (C25 H27 N3 O)

Compound Name

1-[3-(4-methylphenyl)-5H,6H,7H,8H,9H-imidazo[1,5-a]azepine-1-carbonyl]-1,2,3,4-tetrahydroquinoline

IUPAC name

1-[3-(4-methylphenyl)-5H6H7H8H9H-imidazo[15-a]azepine-1-carbonyl]-1234-tetrahydroquinoline

SMILES

Cc(cc1)ccc1-c1nc(C(N(CCC2)c3c2cccc3)=O)c2n1CCCCC2

InChI

InChI=1S/C25H27N3O/c1-18-12-14-20(15-13-18)24-26-23(22-11-3-2-6-16-27(22)24)25(29)28-17-7-9-19-8-4-5-10-21(19)28/h4-5,8,10,12-15H,2-3,6-7,9,11,16-17H2,1H3

InChI Key

ZDZGIIGQNPRZNP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14855694

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.51

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.840

Distribution Coefficient, logD

5.840

Water Solubility, LogSw

-5.37

Polar Surface Area

26.392

Acid Dissociation Constant (pKa)

23.28

Base Dissociation Constant (pKb)

3.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

E475-1033 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

Antiviral Library (67538 compounds)

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

CORONAVIRUS Library (20774 compounds)

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with E475-1033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E475-1033?
Check Price and Availability of E475-1033, 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 E475-1033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E475-1033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E475-1033
  • 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 E475-1033 available by request