V006-6341 Screening compound: 1-(3-dibenzo[b,d]thiophen-4-ylphenyl)-N~5~-(3,4-difluorobenzyl)-1H-imidazole-5-carboxamide

V006-6341 Screening compound: 1-(3-dibenzo[b,d]thiophen-4-ylphenyl)-N~5~-(3,4-difluorobenzyl)-1H-imidazole-5-carboxamide
V006-6341 Screening compound: 1-(3-dibenzo[b,d]thiophen-4-ylphenyl)-N~5~-(3,4-difluorobenzyl)-1H-imidazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-6341
1-(3-dibenzo[b,d]thiophen-4-ylphenyl)-N~5~-(3,4-difluorobenzyl)-1H-imidazole-5-carboxamide

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

V006-6341

Molecular Formula

C29H19F2N3OS (C29 H19 F2 N3 OS)

Compound Name

1-(3-dibenzo[b,d]thiophen-4-ylphenyl)-N~5~-(3,4-difluorobenzyl)-1H-imidazole-5-carboxamide

IUPAC name

N-[(34-difluorophenyl)methyl]-1-(3-{8-thiatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)351012-hexaen-6-yl}phenyl)-1H-imidazole-5-carboxamide

SMILES

O=C(c1cncn1-c1cccc(-c2c3sc(cccc4)c4c3ccc2)c1)NCc(cc1)cc(F)c1F

InChI

InChI=1S/C29H19F2N3OS/c30-24-12-11-18(13-25(24)31)15-33-29(35)26-16-32-17-34(26)20-6-3-5-19(14-20)21-8-4-9-23-22-7-1-2-10-27(22)36-28(21)23/h1-14,16-17H,15H2,(H,33,35)

InChI Key

PVWYAQUOKZSMDU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19963849

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

495.55

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.880

Distribution Coefficient, logD

6.879

Water Solubility, LogSw

-6.26

Polar Surface Area

35.733

Acid Dissociation Constant (pKa)

12.76

Base Dissociation Constant (pKb)

4.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

3.45

References: we are preparing a list of scientific research reports with V006-6341 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-6341?
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What is the minimum amount of V006-6341 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-6341
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-6341
  • 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 V006-6341 available by request