2688-0016 Screening compound: N-(2-benzoyl-4-chlorophenyl)-4-[(6-chloro-4-phenylquinazolin-2-yl)amino]benzamide

2688-0016 Screening compound: N-(2-benzoyl-4-chlorophenyl)-4-[(6-chloro-4-phenylquinazolin-2-yl)amino]benzamide
2688-0016 Screening compound: N-(2-benzoyl-4-chlorophenyl)-4-[(6-chloro-4-phenylquinazolin-2-yl)amino]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2688-0016
N-(2-benzoyl-4-chlorophenyl)-4-[(6-chloro-4-phenylquinazolin-2-yl)amino]benzamide

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

2688-0016

Molecular Formula

C34H22Cl2N4O2 (C34 H22 Cl2 N4 O2)

Compound Name

N-(2-benzoyl-4-chlorophenyl)-4-[(6-chloro-4-phenylquinazolin-2-yl)amino]benzamide

IUPAC name

N-(2-benzoyl-4-chlorophenyl)-4-[(6-chloro-4-phenylquinazolin-2-yl)amino]benzamide

SMILES

O=C(c1ccccc1)c(cc(cc1)Cl)c1NC(c(cc1)ccc1Nc1nc(-c2ccccc2)c(cc(cc2)Cl)c2n1)=O

InChI

InChI=1S/C34H22Cl2N4O2/c35-24-13-17-29-27(19-24)31(21-7-3-1-4-8-21)40-34(39-29)37-26-15-11-23(12-16-26)33(42)38-30-18-14-25(36)20-28(30)32(41)22-9-5-2-6-10-22/h1-20H,(H,38,42)(H,37,39,40)

InChI Key

FFPLONCGZKKELF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01932595

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

589.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

8.815

Distribution Coefficient, logD

8.603

Water Solubility, LogSw

-6.69

Polar Surface Area

64.931

Acid Dissociation Constant (pKa)

7.60

Base Dissociation Constant (pKb)

4.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

2688-0016 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2688-0016 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2688-0016?
Check Price and Availability of 2688-0016, 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 2688-0016 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2688-0016
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2688-0016
  • 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 2688-0016 available by request