V011-6344 Screening compound: ethyl 1-[4-(trifluoromethyl)benzyl]-2-{[3-(trifluoromethyl)benzyl]sulfanyl}-1H-1,3-benzimidazole-5-carboxylate

V011-6344 Screening compound: ethyl 1-[4-(trifluoromethyl)benzyl]-2-{[3-(trifluoromethyl)benzyl]sulfanyl}-1H-1,3-benzimidazole-5-carboxylate
V011-6344 Screening compound: ethyl 1-[4-(trifluoromethyl)benzyl]-2-{[3-(trifluoromethyl)benzyl]sulfanyl}-1H-1,3-benzimidazole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-6344
ethyl 1-[4-(trifluoromethyl)benzyl]-2-{[3-(trifluoromethyl)benzyl]sulfanyl}-1H-1,3-benzimidazole-5-carboxylate

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

V011-6344

Molecular Formula

C26H20F6N2O2S (C26 H20 F6 N2 O2 S)

Compound Name

ethyl 1-[4-(trifluoromethyl)benzyl]-2-{[3-(trifluoromethyl)benzyl]sulfanyl}-1H-1,3-benzimidazole-5-carboxylate

IUPAC name

ethyl 1-{[4-(trifluoromethyl)phenyl]methyl}-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-1H-13-benzodiazole-5-carboxylate

SMILES

CCOC(c(cc1)cc2c1n(Cc1ccc(C(F)(F)F)cc1)c(SCc1cc(C(F)(F)F)ccc1)n2)=O

InChI

InChI=1S/C26H20F6N2O2S/c1-2-36-23(35)18-8-11-22-21(13-18)33-24(37-15-17-4-3-5-20(12-17)26(30,31)32)34(22)14-16-6-9-19(10-7-16)25(27,28)29/h3-13H,2,14-15H2,1H3

InChI Key

GIPQPIUWHUSNGG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19963926

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

538.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

8.012

Distribution Coefficient, logD

8.005

Water Solubility, LogSw

-5.79

Polar Surface Area

31.231

Acid Dissociation Constant (pKa)

22.97

Base Dissociation Constant (pKb)

5.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.08

References: we are preparing a list of scientific research reports with V011-6344 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-6344?
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What is the minimum amount of V011-6344 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-6344
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-6344
  • 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 V011-6344 available by request