V006-6329 Screening compound: 1-[1-(3-chlorobenzoyl)piperidin-4-yl]-6-fluoro-2-phenyl-1H-1,3-benzodiazole

V006-6329 Screening compound: 1-[1-(3-chlorobenzoyl)piperidin-4-yl]-6-fluoro-2-phenyl-1H-1,3-benzodiazole
V006-6329 Screening compound: 1-[1-(3-chlorobenzoyl)piperidin-4-yl]-6-fluoro-2-phenyl-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-6329
1-[1-(3-chlorobenzoyl)piperidin-4-yl]-6-fluoro-2-phenyl-1H-1,3-benzodiazole

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

V006-6329

Molecular Formula

C25H21ClFN3O (C25 H21 ClFN3 O)

Compound Name

1-[1-(3-chlorobenzoyl)piperidin-4-yl]-6-fluoro-2-phenyl-1H-1,3-benzodiazole

IUPAC name

1-[1-(3-chlorobenzoyl)piperidin-4-yl]-6-fluoro-2-phenyl-1H-13-benzodiazole

SMILES

O=C(c1cccc(Cl)c1)N(CC1)CCC1n1c(-c2ccccc2)nc(cc2)c1cc2F

InChI

InChI=1S/C25H21ClFN3O/c26-19-8-4-7-18(15-19)25(31)29-13-11-21(12-14-29)30-23-16-20(27)9-10-22(23)28-24(30)17-5-2-1-3-6-17/h1-10,15-16,21H,11-14H2

InChI Key

RSPGTYMFMZRWFP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19953784

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

433.91

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.720

Distribution Coefficient, logD

5.720

Water Solubility, LogSw

-5.99

Polar Surface Area

26.928

Acid Dissociation Constant (pKa)

21.48

Base Dissociation Constant (pKb)

2.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

V006-6329 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 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

References: we are preparing a list of scientific research reports with V006-6329 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-6329?
Check Price and Availability of V006-6329, 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 V006-6329 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-6329
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-6329
  • 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 V006-6329 available by request