K784-4117 Screening compound: ethyl 4-({N-[(4-chlorophenyl)methyl]4-methylbenzenesulfonamido}methyl)cyclohexane-1-carboxylate

K784-4117 Screening compound: ethyl 4-({N-[(4-chlorophenyl)methyl]4-methylbenzenesulfonamido}methyl)cyclohexane-1-carboxylate
K784-4117 Screening compound: ethyl 4-({N-[(4-chlorophenyl)methyl]4-methylbenzenesulfonamido}methyl)cyclohexane-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-4117
ethyl 4-({N-[(4-chlorophenyl)methyl]4-methylbenzenesulfonamido}methyl)cyclohexane-1-carboxylate

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

K784-4117

Molecular Formula

C24H30ClNO4S (C24 H30 ClNO4 S)

Compound Name

ethyl 4-({N-[(4-chlorophenyl)methyl]4-methylbenzenesulfonamido}methyl)cyclohexane-1-carboxylate

IUPAC name

ethyl 4-({N-[(4-chlorophenyl)methyl]4-methylbenzenesulfonamido}methyl)cyclohexane-1-carboxylate

SMILES

CCOC(C1CCC(CN(Cc(cc2)ccc2Cl)S(c2ccc(C)cc2)(=O)=O)CC1)=O

InChI

InChI=1S/C24H30ClNO4S/c1-3-30-24(27)21-10-6-19(7-11-21)16-26(17-20-8-12-22(25)13-9-20)31(28,29)23-14-4-18(2)5-15-23/h4-5,8-9,12-15,19,21H,3,6-7,10-11,16-17H2,1-2H3

InChI Key

LJIQMRODVYLOCQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15097793

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.03

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.332

Distribution Coefficient, logD

6.332

Water Solubility, LogSw

-6.16

Polar Surface Area

52.288

Acid Dissociation Constant (pKa)

23.26

Base Dissociation Constant (pKb)

-5.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.80

References: we are preparing a list of scientific research reports with K784-4117 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-4117?
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What is the minimum amount of K784-4117 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-4117
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-4117
  • 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 K784-4117 available by request