V003-1228 Screening compound: 3-bromo-N-{1-[1-(propan-2-yl)-1H-1,3-benzodiazol-2-yl]piperidin-4-yl}benzamide

V003-1228 Screening compound: 3-bromo-N-{1-[1-(propan-2-yl)-1H-1,3-benzodiazol-2-yl]piperidin-4-yl}benzamide
V003-1228 Screening compound: 3-bromo-N-{1-[1-(propan-2-yl)-1H-1,3-benzodiazol-2-yl]piperidin-4-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-1228
3-bromo-N-{1-[1-(propan-2-yl)-1H-1,3-benzodiazol-2-yl]piperidin-4-yl}benzamide

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

V003-1228

Molecular Formula

C22H25BrN4O (C22 H25 BrN4 O)

Compound Name

3-bromo-N-{1-[1-(propan-2-yl)-1H-1,3-benzodiazol-2-yl]piperidin-4-yl}benzamide

IUPAC name

3-bromo-N-{1-[1-(propan-2-yl)-1H-13-benzodiazol-2-yl]piperidin-4-yl}benzamide

SMILES

CC(C)n1c(N(CC2)CCC2NC(c2cccc(Br)c2)=O)nc2c1cccc2

InChI

InChI=1S/C22H25BrN4O/c1-15(2)27-20-9-4-3-8-19(20)25-22(27)26-12-10-18(11-13-26)24-21(28)16-6-5-7-17(23)14-16/h3-9,14-15,18H,10-13H2,1-2H3,(H,24,28)

InChI Key

WHDUJIZZBGWTQR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19968926

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

441.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.034

Distribution Coefficient, logD

5.020

Water Solubility, LogSw

-4.68

Polar Surface Area

38.454

Acid Dissociation Constant (pKa)

13.93

Base Dissociation Constant (pKb)

5.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

V003-1228 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V003-1228 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-1228?
Check Price and Availability of V003-1228, 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 V003-1228 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-1228
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-1228
  • 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 V003-1228 available by request