2279-5093 Screening compound: methyl 2-[2-(2-bromo-4-methylphenoxy)acetamido]benzoate

2279-5093 Screening compound: methyl 2-[2-(2-bromo-4-methylphenoxy)acetamido]benzoate
2279-5093 Screening compound: methyl 2-[2-(2-bromo-4-methylphenoxy)acetamido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2279-5093
methyl 2-[2-(2-bromo-4-methylphenoxy)acetamido]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

2279-5093

Molecular Formula

C17H16BrNO4 (C17 H16 BrNO4)

Compound Name

methyl 2-[2-(2-bromo-4-methylphenoxy)acetamido]benzoate

IUPAC name

methyl 2-[2-(2-bromo-4-methylphenoxy)acetamido]benzoate

SMILES

Cc(cc1)cc(Br)c1OCC(Nc(cccc1)c1C(OC)=O)=O

InChI

InChI=1S/C17H16BrNO4/c1-11-7-8-15(13(18)9-11)23-10-16(20)19-14-6-4-3-5-12(14)17(21)22-2/h3-9H,10H2,1-2H3,(H,19,20)

InChI Key

IFEUNMFHJBXBQV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01463129

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.22

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.799

Distribution Coefficient, logD

3.780

Water Solubility, LogSw

-3.99

Polar Surface Area

51.178

Acid Dissociation Constant (pKa)

8.76

Base Dissociation Constant (pKb)

-2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

References: we are preparing a list of scientific research reports with 2279-5093 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2279-5093?
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What is the minimum amount of 2279-5093 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2279-5093
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2279-5093
  • 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 2279-5093 available by request