4257-0727 Screening compound: N-(3-bromophenyl)-2-[N-(2-phenylethyl)4-methoxybenzenesulfonamido]acetamide

4257-0727 Screening compound: N-(3-bromophenyl)-2-[N-(2-phenylethyl)4-methoxybenzenesulfonamido]acetamide
4257-0727 Screening compound: N-(3-bromophenyl)-2-[N-(2-phenylethyl)4-methoxybenzenesulfonamido]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4257-0727
N-(3-bromophenyl)-2-[N-(2-phenylethyl)4-methoxybenzenesulfonamido]acetamide

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

4257-0727

Molecular Formula

C23H23BrN2O4S (C23 H23 BrN2 O4 S)

Compound Name

N-(3-bromophenyl)-2-[N-(2-phenylethyl)4-methoxybenzenesulfonamido]acetamide

IUPAC name

N-(3-bromophenyl)-2-[N-(2-phenylethyl)4-methoxybenzenesulfonamido]acetamide

SMILES

COc(cc1)ccc1S(N(CCc1ccccc1)CC(Nc1cccc(Br)c1)=O)(=O)=O

InChI

InChI=1S/C23H23BrN2O4S/c1-30-21-10-12-22(13-11-21)31(28,29)26(15-14-18-6-3-2-4-7-18)17-23(27)25-20-9-5-8-19(24)16-20/h2-13,16H,14-15,17H2,1H3,(H,25,27)

InChI Key

YIFSRJWQFYVYSD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01901138

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

503.42

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.206

Distribution Coefficient, logD

5.198

Water Solubility, LogSw

-5.07

Polar Surface Area

62.014

Acid Dissociation Constant (pKa)

9.13

Base Dissociation Constant (pKb)

-1.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

4257-0727 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with 4257-0727 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4257-0727?
Check Price and Availability of 4257-0727, 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 4257-0727 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4257-0727
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4257-0727
  • 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 4257-0727 available by request