V023-7959 Screening compound: 2-(4-chlorophenoxy)-N-(6-{4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)acetamide

V023-7959 Screening compound: 2-(4-chlorophenoxy)-N-(6-{4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)acetamide
V023-7959 Screening compound: 2-(4-chlorophenoxy)-N-(6-{4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-7959
2-(4-chlorophenoxy)-N-(6-{4-[(4-fluorophenyl)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

V023-7959

Molecular Formula

C25H26ClFN4O2 (C25 H26 ClFN4 O2)

Compound Name

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

IUPAC name

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

SMILES

O=C(COc(cc1)ccc1Cl)Nc(cc1)cnc1N1CCN(Cc(cc2)ccc2F)CCC1

InChI

InChI=1S/C25H26ClFN4O2/c26-20-4-9-23(10-5-20)33-18-25(32)29-22-8-11-24(28-16-22)31-13-1-12-30(14-15-31)17-19-2-6-21(27)7-3-19/h2-11,16H,1,12-15,17-18H2,(H,29,32)

InChI Key

PGXRETXQSUGSLQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19912112

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

468.96

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.128

Distribution Coefficient, logD

5.043

Water Solubility, LogSw

-5.62

Polar Surface Area

46.540

Acid Dissociation Constant (pKa)

12.08

Base Dissociation Constant (pKb)

6.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

V023-7959 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with V023-7959 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V023-7959?
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What is the minimum amount of V023-7959 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-7959
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-7959
  • 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 V023-7959 available by request