V006-5427 Screening compound: 2-{2-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(2-methylpropyl)pentanamide

V006-5427 Screening compound: 2-{2-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(2-methylpropyl)pentanamide
V006-5427 Screening compound: 2-{2-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(2-methylpropyl)pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-5427
2-{2-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(2-methylpropyl)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

V006-5427

Molecular Formula

C23H28ClN3O (C23 H28 ClN3 O)

Compound Name

2-{2-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(2-methylpropyl)pentanamide

IUPAC name

2-{2-[(2-chlorophenyl)methyl]-1H-13-benzodiazol-1-yl}-N-(2-methylpropyl)pentanamide

SMILES

CCCC(C(NCC(C)C)=O)n1c(cccc2)c2nc1Cc(cccc1)c1Cl

InChI

InChI=1S/C23H28ClN3O/c1-4-9-21(23(28)25-15-16(2)3)27-20-13-8-7-12-19(20)26-22(27)14-17-10-5-6-11-18(17)24/h5-8,10-13,16,21H,4,9,14-15H2,1-3H3,(H,25,28)/t21-/m0/s1

InChI Key

SVGOEDXUQYUWNI-NRFANRHFSA-N

MDL Number (MFCD)

MFCD19781517

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

397.95

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.961

Distribution Coefficient, logD

5.961

Water Solubility, LogSw

-5.97

Polar Surface Area

36.108

Acid Dissociation Constant (pKa)

15.18

Base Dissociation Constant (pKb)

4.21

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.10

V006-5427 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 V006-5427 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-5427?
Check Price and Availability of V006-5427, 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 V006-5427 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-5427
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-5427
  • 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 V006-5427 available by request