E475-1019 Screening compound: 1-[3-(4-methylphenyl)-5H,6H,7H,8H,9H-imidazo[1,5-a]azepine-1-carbonyl]azepane

E475-1019 Screening compound: 1-[3-(4-methylphenyl)-5H,6H,7H,8H,9H-imidazo[1,5-a]azepine-1-carbonyl]azepane
E475-1019 Screening compound: 1-[3-(4-methylphenyl)-5H,6H,7H,8H,9H-imidazo[1,5-a]azepine-1-carbonyl]azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound E475-1019
1-[3-(4-methylphenyl)-5H,6H,7H,8H,9H-imidazo[1,5-a]azepine-1-carbonyl]azepane

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

E475-1019

Molecular Formula

C22H29N3O (C22 H29 N3 O)

Compound Name

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

IUPAC name

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

SMILES

Cc(cc1)ccc1-c1nc(C(N2CCCCCC2)=O)c2n1CCCCC2

InChI

InChI=1S/C22H29N3O/c1-17-10-12-18(13-11-17)21-23-20(19-9-5-4-8-16-25(19)21)22(26)24-14-6-2-3-7-15-24/h10-13H,2-9,14-16H2,1H3

InChI Key

YQDNTYWKYHEDPM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14855681

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.49

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

5.050

Distribution Coefficient, logD

5.050

Water Solubility, LogSw

-4.55

Polar Surface Area

28.058

Acid Dissociation Constant (pKa)

23.28

Base Dissociation Constant (pKb)

2.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.50

E475-1019 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with E475-1019 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E475-1019?
Check Price and Availability of E475-1019, 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 E475-1019 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E475-1019
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E475-1019
  • 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 E475-1019 available by request