R247-0072 Screening compound: 4-[(6-chloro-4-phenylquinazolin-2-yl)amino]benzoic acid

R247-0072 Screening compound: 4-[(6-chloro-4-phenylquinazolin-2-yl)amino]benzoic acid
R247-0072 Screening compound: 4-[(6-chloro-4-phenylquinazolin-2-yl)amino]benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound R247-0072
4-[(6-chloro-4-phenylquinazolin-2-yl)amino]benzoic acid

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

R247-0072

Molecular Formula

C21H14ClN3O2 (C21 H14 ClN3 O2)

Compound Name

4-[(6-chloro-4-phenylquinazolin-2-yl)amino]benzoic acid

IUPAC name

4-[(6-chloro-4-phenylquinazolin-2-yl)amino]benzoic acid

SMILES

OC(c(cc1)ccc1Nc1nc(-c2ccccc2)c(cc(cc2)Cl)c2n1)=O

InChI

InChI=1S/C21H14ClN3O2/c22-15-8-11-18-17(12-15)19(13-4-2-1-3-5-13)25-21(24-18)23-16-9-6-14(7-10-16)20(26)27/h1-12H,(H,26,27)(H,23,24,25)

InChI Key

WJJGWIIFCRITMY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01829434

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.81

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.029

Distribution Coefficient, logD

3.634

Water Solubility, LogSw

-6.00

Polar Surface Area

57.478

Acid Dissociation Constant (pKa)

5.01

Base Dissociation Constant (pKb)

4.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

R247-0072 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

GABA Library (7115 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Eye
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • GPCR
  • Ion Channels
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands
  • Receptor's ligands

References: we are preparing a list of scientific research reports with R247-0072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound R247-0072?
Check Price and Availability of R247-0072, 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 R247-0072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for R247-0072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for R247-0072
  • 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 R247-0072 available by request