1227-0203 Screening compound: 4-[2-bromo-5-(phenylcarbamoyl)benzenesulfonamido]benzoic acid

1227-0203 Screening compound: 4-[2-bromo-5-(phenylcarbamoyl)benzenesulfonamido]benzoic acid
1227-0203 Screening compound: 4-[2-bromo-5-(phenylcarbamoyl)benzenesulfonamido]benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 1227-0203
4-[2-bromo-5-(phenylcarbamoyl)benzenesulfonamido]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

1227-0203

Molecular Formula

C20H15BrN2O5S (C20 H15 BrN2 O5 S)

Compound Name

4-[2-bromo-5-(phenylcarbamoyl)benzenesulfonamido]benzoic acid

IUPAC name

4-[2-bromo-5-(phenylcarbamoyl)benzenesulfonamido]benzoic acid

SMILES

OC(c(cc1)ccc1NS(c(cc(cc1)C(Nc2ccccc2)=O)c1Br)(=O)=O)=O

InChI

InChI=1S/C20H15BrN2O5S/c21-17-11-8-14(19(24)22-15-4-2-1-3-5-15)12-18(17)29(27,28)23-16-9-6-13(7-10-16)20(25)26/h1-12,23H,(H,22,24)(H,25,26)

InChI Key

WVHQZOPXYBEGBC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00492993

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.32

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.219

Distribution Coefficient, logD

1.824

Water Solubility, LogSw

-4.37

Polar Surface Area

92.387

Acid Dissociation Constant (pKa)

5.01

Base Dissociation Constant (pKb)

-2.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

1227-0203 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1227-0203 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1227-0203?
Check Price and Availability of 1227-0203, 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 1227-0203 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1227-0203
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1227-0203
  • 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 1227-0203 available by request