2279-0826 Screening compound: methyl 4-{[(2-methylphenyl)carbamoyl]amino}benzoate

2279-0826 Screening compound: methyl 4-{[(2-methylphenyl)carbamoyl]amino}benzoate
2279-0826 Screening compound: methyl 4-{[(2-methylphenyl)carbamoyl]amino}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2279-0826
methyl 4-{[(2-methylphenyl)carbamoyl]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

2279-0826

Molecular Formula

C16H16N2O3 (C16 H16 N2 O3)

Compound Name

methyl 4-{[(2-methylphenyl)carbamoyl]amino}benzoate

IUPAC name

methyl 4-{[(2-methylphenyl)carbamoyl]amino}benzoate

SMILES

Cc(cccc1)c1NC(Nc(cc1)ccc1C(OC)=O)=O

InChI

InChI=1S/C16H16N2O3/c1-11-5-3-4-6-14(11)18-16(20)17-13-9-7-12(8-10-13)15(19)21-2/h3-10H,1-2H3,(H2,17,18,20)

InChI Key

CDNAHPOETPIMFD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01910592

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

284.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.558

Distribution Coefficient, logD

3.558

Water Solubility, LogSw

-3.52

Polar Surface Area

53.017

Acid Dissociation Constant (pKa)

11.40

Base Dissociation Constant (pKb)

-0.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

2279-0826 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

Integrin Receptors Targeted library (1715 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Targets:
  • Others

References: we are preparing a list of scientific research reports with 2279-0826 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2279-0826?
Check Price and Availability of 2279-0826, 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 2279-0826 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2279-0826
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2279-0826
  • 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 2279-0826 available by request