Y050-0584 Screening compound: 2-(N-benzyl3-chloro-4-methoxybenzenesulfonamido)-N-cyclohexylacetamide

Y050-0584 Screening compound: 2-(N-benzyl3-chloro-4-methoxybenzenesulfonamido)-N-cyclohexylacetamide
Y050-0584 Screening compound: 2-(N-benzyl3-chloro-4-methoxybenzenesulfonamido)-N-cyclohexylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y050-0584
2-(N-benzyl3-chloro-4-methoxybenzenesulfonamido)-N-cyclohexylacetamide

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

Y050-0584

Molecular Formula

C22H27ClN2O4S (C22 H27 ClN2 O4 S)

Compound Name

2-(N-benzyl3-chloro-4-methoxybenzenesulfonamido)-N-cyclohexylacetamide

IUPAC name

2-(N-benzyl3-chloro-4-methoxybenzenesulfonamido)-N-cyclohexylacetamide

SMILES

COc(ccc(S(N(CC(NC1CCCCC1)=O)Cc1ccccc1)(=O)=O)c1)c1Cl

InChI

InChI=1S/C22H27ClN2O4S/c1-29-21-13-12-19(14-20(21)23)30(27,28)25(15-17-8-4-2-5-9-17)16-22(26)24-18-10-6-3-7-11-18/h2,4-5,8-9,12-14,18H,3,6-7,10-11,15-16H2,1H3,(H,24,26)

InChI Key

BLXXDDIZNOSYBL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06632471

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.99

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.264

Distribution Coefficient, logD

4.264

Water Solubility, LogSw

-4.50

Polar Surface Area

63.169

Acid Dissociation Constant (pKa)

13.84

Base Dissociation Constant (pKb)

3.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

References: we are preparing a list of scientific research reports with Y050-0584 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y050-0584?
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What is the minimum amount of Y050-0584 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y050-0584
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y050-0584
  • 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 Y050-0584 available by request