V004-1640 Screening compound: 2-{2-[(4-fluorophenyl)methyl]-5,6-dimethyl-1H-1,3-benzodiazol-1-yl}-N-[2-(pyridin-2-yl)ethyl]pentanamide

V004-1640 Screening compound: 2-{2-[(4-fluorophenyl)methyl]-5,6-dimethyl-1H-1,3-benzodiazol-1-yl}-N-[2-(pyridin-2-yl)ethyl]pentanamide
V004-1640 Screening compound: 2-{2-[(4-fluorophenyl)methyl]-5,6-dimethyl-1H-1,3-benzodiazol-1-yl}-N-[2-(pyridin-2-yl)ethyl]pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-1640
2-{2-[(4-fluorophenyl)methyl]-5,6-dimethyl-1H-1,3-benzodiazol-1-yl}-N-[2-(pyridin-2-yl)ethyl]pentanamide

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

V004-1640

Molecular Formula

C28H31FN4O (C28 H31 FN4 O)

Compound Name

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

IUPAC name

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

SMILES

CCCC(C(NCCc1ncccc1)=O)n1c(cc(C)c(C)c2)c2nc1Cc(cc1)ccc1F

InChI

InChI=1S/C28H31FN4O/c1-4-7-25(28(34)31-15-13-23-8-5-6-14-30-23)33-26-17-20(3)19(2)16-24(26)32-27(33)18-21-9-11-22(29)12-10-21/h5-6,8-12,14,16-17,25H,4,7,13,15,18H2,1-3H3,(H,31,34)/t25-/m0/s1

InChI Key

UYHQYOZVSKNHQC-VWLOTQADSA-N

MDL Number (MFCD)

MFCD19785917

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

458.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.603

Distribution Coefficient, logD

5.598

Water Solubility, LogSw

-5.33

Polar Surface Area

45.221

Acid Dissociation Constant (pKa)

13.77

Base Dissociation Constant (pKb)

5.45

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

32.10

V004-1640 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Neuropeptide S Library (2850 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Digestive system
  • Nervous system
Targets:
  • Kinases
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V004-1640 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-1640?
Check Price and Availability of V004-1640, 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 V004-1640 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-1640
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-1640
  • 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 V004-1640 available by request