V021-9124 Screening compound: N-(6-{4-[(4-chlorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-3,5-difluorobenzamide

V021-9124 Screening compound: N-(6-{4-[(4-chlorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-3,5-difluorobenzamide
V021-9124 Screening compound: N-(6-{4-[(4-chlorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-3,5-difluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-9124
N-(6-{4-[(4-chlorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-3,5-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

V021-9124

Molecular Formula

C24H23ClF2N4O (C24 H23 ClF2 N4 O)

Compound Name

N-(6-{4-[(4-chlorophenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)-3,5-difluorobenzamide

IUPAC name

N-(6-{4-[(4-chlorophenyl)methyl]-14-diazepan-1-yl}pyridin-3-yl)-35-difluorobenzamide

SMILES

O=C(c1cc(F)cc(F)c1)Nc(cc1)cnc1N1CCN(Cc(cc2)ccc2Cl)CCC1

InChI

InChI=1S/C24H23ClF2N4O/c25-19-4-2-17(3-5-19)16-30-8-1-9-31(11-10-30)23-7-6-22(15-28-23)29-24(32)18-12-20(26)14-21(27)13-18/h2-7,12-15H,1,8-11,16H2,(H,29,32)

InChI Key

AVXWETCUUPHTJM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19912284

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

456.92

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

5.601

Distribution Coefficient, logD

5.524

Water Solubility, LogSw

-6.06

Polar Surface Area

39.254

Acid Dissociation Constant (pKa)

8.82

Base Dissociation Constant (pKb)

6.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

V021-9124 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 V021-9124 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-9124?
Check Price and Availability of V021-9124, 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 V021-9124 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-9124
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-9124
  • 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 V021-9124 available by request