4300-0169 Screening compound: methyl 3-[(6-methylquinazolin-4-yl)amino]benzoate

4300-0169 Screening compound: methyl 3-[(6-methylquinazolin-4-yl)amino]benzoate
4300-0169 Screening compound: methyl 3-[(6-methylquinazolin-4-yl)amino]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4300-0169
methyl 3-[(6-methylquinazolin-4-yl)amino]benzoate

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

4300-0169

Molecular Formula

C17H15N3O2 (C17 H15 N3 O2)

Compound Name

methyl 3-[(6-methylquinazolin-4-yl)amino]benzoate

IUPAC name

methyl 3-[(6-methylquinazolin-4-yl)amino]benzoate

SMILES

Cc(cc12)ccc2ncnc1Nc1cccc(C(OC)=O)c1

InChI

InChI=1S/C17H15N3O2/c1-11-6-7-15-14(8-11)16(19-10-18-15)20-13-5-3-4-12(9-13)17(21)22-2/h3-10H,1-2H3,(H,18,19,20)

InChI Key

YJEQJJSUJVLTFL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02332224

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

293.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.342

Distribution Coefficient, logD

4.329

Water Solubility, LogSw

-4.44

Polar Surface Area

50.489

Acid Dissociation Constant (pKa)

16.99

Base Dissociation Constant (pKb)

5.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

4300-0169 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Cardiovascular Library (22201 compounds)

Lipid Metabolism Library (9174 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Cardiovascular
  • Metabolic
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 4300-0169 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4300-0169?
Check Price and Availability of 4300-0169, 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 4300-0169 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4300-0169
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4300-0169
  • 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 4300-0169 available by request