V020-6388 Screening compound: 2-phenoxy-N-(6-{4-[(pyridin-4-yl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)acetamide

V020-6388 Screening compound: 2-phenoxy-N-(6-{4-[(pyridin-4-yl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)acetamide
V020-6388 Screening compound: 2-phenoxy-N-(6-{4-[(pyridin-4-yl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-6388
2-phenoxy-N-(6-{4-[(pyridin-4-yl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)acetamide

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

V020-6388

Molecular Formula

C24H27N5O2 (C24 H27 N5 O2)

Compound Name

2-phenoxy-N-(6-{4-[(pyridin-4-yl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)acetamide

IUPAC name

2-phenoxy-N-(6-{4-[(pyridin-4-yl)methyl]-14-diazepan-1-yl}pyridin-3-yl)acetamide

SMILES

O=C(COc1ccccc1)Nc(cc1)cnc1N1CCN(Cc2ccncc2)CCC1

InChI

InChI=1S/C24H27N5O2/c30-24(19-31-22-5-2-1-3-6-22)27-21-7-8-23(26-17-21)29-14-4-13-28(15-16-29)18-20-9-11-25-12-10-20/h1-3,5-12,17H,4,13-16,18-19H2,(H,27,30)

InChI Key

LXBIAHOPYLMOAR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19912336

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

417.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.119

Distribution Coefficient, logD

3.095

Water Solubility, LogSw

-2.88

Polar Surface Area

55.968

Acid Dissociation Constant (pKa)

12.08

Base Dissociation Constant (pKb)

6.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.17

V020-6388 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

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

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • 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 V020-6388 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-6388?
Check Price and Availability of V020-6388, 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 V020-6388 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-6388
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-6388
  • 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 V020-6388 available by request