F154-0408 Screening compound: 4-[(2-{[(4-methoxyphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide

F154-0408 Screening compound: 4-[(2-{[(4-methoxyphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
F154-0408 Screening compound: 4-[(2-{[(4-methoxyphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F154-0408
4-[(2-{[(4-methoxyphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-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

F154-0408

Molecular Formula

C32H30N4O2S (C32 H30 N4 O2 S)

Compound Name

4-[(2-{[(4-methoxyphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide

IUPAC name

4-[(2-{[(4-methoxyphenyl)methyl]sulfanyl}-3H-imidazo[45-c]pyridin-3-yl)methyl]-N-(1234-tetrahydronaphthalen-1-yl)benzamide

SMILES

COc1ccc(CSc2nc(ccnc3)c3n2Cc(cc2)ccc2C(NC(CCC2)c3c2cccc3)=O)cc1

InChI

InChI=1S/C32H30N4O2S/c1-38-26-15-11-23(12-16-26)21-39-32-35-29-17-18-33-19-30(29)36(32)20-22-9-13-25(14-10-22)31(37)34-28-8-4-6-24-5-2-3-7-27(24)28/h2-3,5,7,9-19,28H,4,6,8,20-21H2,1H3,(H,34,37)/t28-/m0/s1

InChI Key

SDMSKYYSHBYLRU-NDEPHWFRSA-N

MDL Number (MFCD)

MFCD14943634

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

534.68

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.036

Distribution Coefficient, logD

6.033

Water Solubility, LogSw

-5.21

Polar Surface Area

51.796

Acid Dissociation Constant (pKa)

10.61

Base Dissociation Constant (pKb)

5.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.90

F154-0408 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GABA Library (7115 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • GPCR
  • Ion Channels
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F154-0408 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F154-0408?
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What is the minimum amount of F154-0408 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F154-0408
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F154-0408
  • 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 F154-0408 available by request