Y041-6523 Screening compound: 4-[(4-chlorobenzenesulfonamido)methyl]cyclohexane-1-carboxylic acid

Y041-6523 Screening compound: 4-[(4-chlorobenzenesulfonamido)methyl]cyclohexane-1-carboxylic acid
Y041-6523 Screening compound: 4-[(4-chlorobenzenesulfonamido)methyl]cyclohexane-1-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-6523
4-[(4-chlorobenzenesulfonamido)methyl]cyclohexane-1-carboxylic 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

Y041-6523

Molecular Formula

C14H18ClNO4S (C14 H18 ClNO4 S)

Compound Name

4-[(4-chlorobenzenesulfonamido)methyl]cyclohexane-1-carboxylic acid

IUPAC name

(1r4r)-4-[(4-chlorobenzenesulfonamido)methyl]cyclohexane-1-carboxylic acid

SMILES

OC([C@H]1CC[C@H](CNS(c(cc2)ccc2Cl)(=O)=O)CC1)=O

InChI

InChI=1S/C14H18ClNO4S/c15-12-5-7-13(8-6-12)21(19,20)16-9-10-1-3-11(4-2-10)14(17)18/h5-8,10-11,16H,1-4,9H2,(H,17,18)

InChI Key

QSAMXYYSGGMNTJ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.82

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.838

Distribution Coefficient, logD

0.278

Water Solubility, LogSw

-3.22

Polar Surface Area

70.597

Acid Dissociation Constant (pKa)

4.84

Base Dissociation Constant (pKb)

-5.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

Y041-6523 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y041-6523 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-6523?
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What is the minimum amount of Y041-6523 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-6523
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-6523
  • 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 Y041-6523 available by request