3010-1033 Screening compound: 4-(azepane-1-carbonyl)-2-phenylquinoline

3010-1033 Screening compound: 4-(azepane-1-carbonyl)-2-phenylquinoline
3010-1033 Screening compound: 4-(azepane-1-carbonyl)-2-phenylquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 3010-1033
4-(azepane-1-carbonyl)-2-phenylquinoline

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

3010-1033

Molecular Formula

C22H22N2O (C22 H22 N2 O)

Compound Name

4-(azepane-1-carbonyl)-2-phenylquinoline

IUPAC name

4-(azepane-1-carbonyl)-2-phenylquinoline

SMILES

O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCCCCC1

InChI

InChI=1S/C22H22N2O/c25-22(24-14-8-1-2-9-15-24)19-16-21(17-10-4-3-5-11-17)23-20-13-7-6-12-18(19)20/h3-7,10-13,16H,1-2,8-9,14-15H2

InChI Key

BAEJBVMLFDYDBQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00838796

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.43

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.172

Distribution Coefficient, logD

5.172

Water Solubility, LogSw

-5.49

Polar Surface Area

25.277

Acid Dissociation Constant (pKa)

27.87

Base Dissociation Constant (pKb)

4.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

3010-1033 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 3010-1033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3010-1033?
Check Price and Availability of 3010-1033, 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 3010-1033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3010-1033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3010-1033
  • 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 3010-1033 available by request