V001-7035 Screening compound: 2-(3,4-difluorophenyl)-1-{4-[5-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]piperidino}-1-ethanone

V001-7035 Screening compound: 2-(3,4-difluorophenyl)-1-{4-[5-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]piperidino}-1-ethanone
V001-7035 Screening compound: 2-(3,4-difluorophenyl)-1-{4-[5-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]piperidino}-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-7035
2-(3,4-difluorophenyl)-1-{4-[5-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]piperidino}-1-ethanone

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

V001-7035

Molecular Formula

C21H18F5N3O (C21 H18 F5 N3 O)

Compound Name

2-(3,4-difluorophenyl)-1-{4-[5-(trifluoromethyl)-1H-1,3-benzimidazol-1-yl]piperidino}-1-ethanone

IUPAC name

2-(34-difluorophenyl)-1-{4-[5-(trifluoromethyl)-1H-13-benzodiazol-1-yl]piperidin-1-yl}ethan-1-one

SMILES

O=C(Cc(cc1)cc(F)c1F)N(CC1)CCC1n1c(ccc(C(F)(F)F)c2)c2nc1

InChI

InChI=1S/C21H18F5N3O/c22-16-3-1-13(9-17(16)23)10-20(30)28-7-5-15(6-8-28)29-12-27-18-11-14(21(24,25)26)2-4-19(18)29/h1-4,9,11-12,15H,5-8,10H2

InChI Key

RNZAKUDITBHOJH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19952455

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

423.39

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.395

Distribution Coefficient, logD

4.395

Water Solubility, LogSw

-4.49

Polar Surface Area

26.644

Acid Dissociation Constant (pKa)

17.35

Base Dissociation Constant (pKb)

3.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

References: we are preparing a list of scientific research reports with V001-7035 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-7035?
Check Price and Availability of V001-7035, 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 V001-7035 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-7035
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-7035
  • 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 V001-7035 available by request