V004-4926 Screening compound: 2-{2-[(4-fluorophenyl)methyl]-5,6-dimethyl-1H-1,3-benzodiazol-1-yl}-2-phenyl-N-[(pyridin-4-yl)methyl]acetamide

V004-4926 Screening compound: 2-{2-[(4-fluorophenyl)methyl]-5,6-dimethyl-1H-1,3-benzodiazol-1-yl}-2-phenyl-N-[(pyridin-4-yl)methyl]acetamide
V004-4926 Screening compound: 2-{2-[(4-fluorophenyl)methyl]-5,6-dimethyl-1H-1,3-benzodiazol-1-yl}-2-phenyl-N-[(pyridin-4-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-4926
2-{2-[(4-fluorophenyl)methyl]-5,6-dimethyl-1H-1,3-benzodiazol-1-yl}-2-phenyl-N-[(pyridin-4-yl)methyl]acetamide

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

V004-4926

Molecular Formula

C30H27FN4O (C30 H27 FN4 O)

Compound Name

2-{2-[(4-fluorophenyl)methyl]-5,6-dimethyl-1H-1,3-benzodiazol-1-yl}-2-phenyl-N-[(pyridin-4-yl)methyl]acetamide

IUPAC name

2-{2-[(4-fluorophenyl)methyl]-56-dimethyl-1H-13-benzodiazol-1-yl}-2-phenyl-N-[(pyridin-4-yl)methyl]acetamide

SMILES

Cc(c(C)c1)cc2c1nc(Cc(cc1)ccc1F)n2C(C(NCc1ccncc1)=O)c1ccccc1

InChI

InChI=1S/C30H27FN4O/c1-20-16-26-27(17-21(20)2)35(28(34-26)18-22-8-10-25(31)11-9-22)29(24-6-4-3-5-7-24)30(36)33-19-23-12-14-32-15-13-23/h3-17,29H,18-19H2,1-2H3,(H,33,36)/t29-/m1/s1

InChI Key

PHOVFIQJEUDBQG-GDLZYMKVSA-N

MDL Number (MFCD)

MFCD19977959

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

478.57

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.307

Distribution Coefficient, logD

5.304

Water Solubility, LogSw

-5.19

Polar Surface Area

45.029

Acid Dissociation Constant (pKa)

12.27

Base Dissociation Constant (pKb)

5.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

V004-4926 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

CNS Targets (44014 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V004-4926 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-4926?
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What is the minimum amount of V004-4926 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-4926
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-4926
  • 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 V004-4926 available by request