K788-4669 Screening compound: N-benzyl-3-butanamido-4-(4-chlorobenzenesulfonyl)benzamide

K788-4669 Screening compound: N-benzyl-3-butanamido-4-(4-chlorobenzenesulfonyl)benzamide
K788-4669 Screening compound: N-benzyl-3-butanamido-4-(4-chlorobenzenesulfonyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K788-4669
N-benzyl-3-butanamido-4-(4-chlorobenzenesulfonyl)benzamide

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

K788-4669

Molecular Formula

C24H23ClN2O4S (C24 H23 ClN2 O4 S)

Compound Name

N-benzyl-3-butanamido-4-(4-chlorobenzenesulfonyl)benzamide

IUPAC name

N-benzyl-3-butanamido-4-(4-chlorobenzenesulfonyl)benzamide

SMILES

CCCC(Nc(cc(cc1)C(NCc2ccccc2)=O)c1S(c(cc1)ccc1Cl)(=O)=O)=O

InChI

InChI=1S/C24H23ClN2O4S/c1-2-6-23(28)27-21-15-18(24(29)26-16-17-7-4-3-5-8-17)9-14-22(21)32(30,31)20-12-10-19(25)11-13-20/h3-5,7-15H,2,6,16H2,1H3,(H,26,29)(H,27,28)

InChI Key

DLVWFTYPYMWUDQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15105139

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.98

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.446

Distribution Coefficient, logD

4.446

Water Solubility, LogSw

-4.62

Polar Surface Area

76.604

Acid Dissociation Constant (pKa)

10.96

Base Dissociation Constant (pKb)

-3.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

K788-4669 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with K788-4669 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K788-4669?
Check Price and Availability of K788-4669, 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 K788-4669 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K788-4669
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K788-4669
  • 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 K788-4669 available by request