Y207-0546 Screening compound: 3-{[(2-bromoanilino)carbonyl]amino}-4-methylbenzoic acid

Y207-0546 Screening compound: 3-{[(2-bromoanilino)carbonyl]amino}-4-methylbenzoic acid
Y207-0546 Screening compound: 3-{[(2-bromoanilino)carbonyl]amino}-4-methylbenzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y207-0546
3-{[(2-bromoanilino)carbonyl]amino}-4-methylbenzoic 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

Y207-0546

Molecular Formula

C15H13BrN2O3 (C15 H13 BrN2 O3)

Compound Name

3-{[(2-bromoanilino)carbonyl]amino}-4-methylbenzoic acid

IUPAC name

3-{[(2-bromophenyl)carbamoyl]amino}-4-methylbenzoic acid

SMILES

Cc(ccc(C(O)=O)c1)c1NC(Nc(cccc1)c1Br)=O

InChI

InChI=1S/C15H13BrN2O3/c1-9-6-7-10(14(19)20)8-13(9)18-15(21)17-12-5-3-2-4-11(12)16/h2-8H,1H3,(H,19,20)(H2,17,18,21)

InChI Key

IHALCHYOZOBJKZ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.18

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.841

Distribution Coefficient, logD

1.373

Water Solubility, LogSw

-3.97

Polar Surface Area

59.554

Acid Dissociation Constant (pKa)

4.93

Base Dissociation Constant (pKb)

-2.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.67

References: we are preparing a list of scientific research reports with Y207-0546 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y207-0546?
Check Price and Availability of Y207-0546, 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 Y207-0546 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y207-0546
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y207-0546
  • 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 Y207-0546 available by request