V003-6457 Screening compound: 2-(N-benzyl-1-cyclopropylformamido)-N-[4-(4-chlorophenyl)-1-(4-methylphenyl)-1H-imidazol-2-yl]acetamide

V003-6457 Screening compound: 2-(N-benzyl-1-cyclopropylformamido)-N-[4-(4-chlorophenyl)-1-(4-methylphenyl)-1H-imidazol-2-yl]acetamide
V003-6457 Screening compound: 2-(N-benzyl-1-cyclopropylformamido)-N-[4-(4-chlorophenyl)-1-(4-methylphenyl)-1H-imidazol-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-6457
2-(N-benzyl-1-cyclopropylformamido)-N-[4-(4-chlorophenyl)-1-(4-methylphenyl)-1H-imidazol-2-yl]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

V003-6457

Molecular Formula

C29H27ClN4O2 (C29 H27 ClN4 O2)

Compound Name

2-(N-benzyl-1-cyclopropylformamido)-N-[4-(4-chlorophenyl)-1-(4-methylphenyl)-1H-imidazol-2-yl]acetamide

IUPAC name

2-(N-benzyl-1-cyclopropylformamido)-N-[4-(4-chlorophenyl)-1-(4-methylphenyl)-1H-imidazol-2-yl]acetamide

SMILES

Cc(cc1)ccc1-n1c(NC(CN(Cc2ccccc2)C(C2CC2)=O)=O)nc(-c(cc2)ccc2Cl)c1

InChI

InChI=1S/C29H27ClN4O2/c1-20-7-15-25(16-8-20)34-18-26(22-11-13-24(30)14-12-22)31-29(34)32-27(35)19-33(28(36)23-9-10-23)17-21-5-3-2-4-6-21/h2-8,11-16,18,23H,9-10,17,19H2,1H3,(H,31,32,35)

InChI Key

AKFGQIILBDHPEN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19826283

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

499.01

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.368

Distribution Coefficient, logD

6.368

Water Solubility, LogSw

-6.26

Polar Surface Area

52.916

Acid Dissociation Constant (pKa)

12.87

Base Dissociation Constant (pKb)

2.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.70

V003-6457 in Drug Discovery

Included in Screening Libraries

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

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with V003-6457 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-6457?
Check Price and Availability of V003-6457, 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 V003-6457 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-6457
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-6457
  • 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 V003-6457 available by request