V023-9574 Screening compound: N-(6-{4-[(2,4-difluorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-2,4-difluorobenzamide

V023-9574 Screening compound: N-(6-{4-[(2,4-difluorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-2,4-difluorobenzamide
V023-9574 Screening compound: N-(6-{4-[(2,4-difluorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-2,4-difluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-9574
N-(6-{4-[(2,4-difluorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-2,4-difluorobenzamide

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

V023-9574

Molecular Formula

C24H22F4N4O (C24 H22 F4 N4 O)

Compound Name

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

IUPAC name

N-(6-{4-[(24-difluorophenyl)methyl]-14-diazepan-1-yl}pyridin-3-yl)-24-difluorobenzamide

SMILES

O=C(c(ccc(F)c1)c1F)Nc(cc1)cnc1N1CCN(Cc(ccc(F)c2)c2F)CCC1

InChI

InChI=1S/C24H22F4N4O/c25-17-3-2-16(21(27)12-17)15-31-8-1-9-32(11-10-31)23-7-5-19(14-29-23)30-24(33)20-6-4-18(26)13-22(20)28/h2-7,12-14H,1,8-11,15H2,(H,30,33)

InChI Key

RWLVZPPOUMPCFF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19912277

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

458.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.108

Distribution Coefficient, logD

5.053

Water Solubility, LogSw

-5.06

Polar Surface Area

39.254

Acid Dissociation Constant (pKa)

8.74

Base Dissociation Constant (pKb)

6.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

V023-9574 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with V023-9574 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V023-9574?
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What is the minimum amount of V023-9574 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-9574
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-9574
  • 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 V023-9574 available by request