V027-5121 Screening compound: 2-{2-[(2,6-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-[2-(pyridin-2-yl)ethyl]pentanamide

V027-5121 Screening compound: 2-{2-[(2,6-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-[2-(pyridin-2-yl)ethyl]pentanamide
V027-5121 Screening compound: 2-{2-[(2,6-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-[2-(pyridin-2-yl)ethyl]pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-5121
2-{2-[(2,6-dichlorophenyl)methyl]-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

V027-5121

Molecular Formula

C26H26Cl2N4O (C26 H26 Cl2 N4 O)

Compound Name

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

IUPAC name

2-{2-[(26-dichlorophenyl)methyl]-1H-13-benzodiazol-1-yl}-N-[2-(pyridin-2-yl)ethyl]pentanamide

SMILES

CCCC(C(NCCc1ncccc1)=O)n1c(cccc2)c2nc1Cc(c(Cl)ccc1)c1Cl

InChI

InChI=1S/C26H26Cl2N4O/c1-2-8-24(26(33)30-16-14-18-9-5-6-15-29-18)32-23-13-4-3-12-22(23)31-25(32)17-19-20(27)10-7-11-21(19)28/h3-7,9-13,15,24H,2,8,14,16-17H2,1H3,(H,30,33)/t24-/m0/s1

InChI Key

OREFRFLCNWRGHA-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD19785583

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

481.42

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

5.804

Distribution Coefficient, logD

5.799

Water Solubility, LogSw

-5.87

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

26.90

V027-5121 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V027-5121 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-5121?
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What is the minimum amount of V027-5121 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-5121
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-5121
  • 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 V027-5121 available by request