K788-2781 Screening compound: N-({4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]cyclohexyl}methyl)-4-methylbenzene-1-sulfonamide

K788-2781 Screening compound: N-({4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]cyclohexyl}methyl)-4-methylbenzene-1-sulfonamide
K788-2781 Screening compound: N-({4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]cyclohexyl}methyl)-4-methylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K788-2781
N-({4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]cyclohexyl}methyl)-4-methylbenzene-1-sulfonamide

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

K788-2781

Molecular Formula

C26H35N3O4S (C26 H35 N3 O4 S)

Compound Name

N-({4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]cyclohexyl}methyl)-4-methylbenzene-1-sulfonamide

IUPAC name

N-({4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]cyclohexyl}methyl)-4-methylbenzene-1-sulfonamide

SMILES

Cc(cc1)ccc1S(NCC(CC1)CCC1C(N(CC1)CCN1c(cccc1)c1OC)=O)(=O)=O

InChI

InChI=1S/C26H35N3O4S/c1-20-7-13-23(14-8-20)34(31,32)27-19-21-9-11-22(12-10-21)26(30)29-17-15-28(16-18-29)24-5-3-4-6-25(24)33-2/h3-8,13-14,21-22,27H,9-12,15-19H2,1-2H3

InChI Key

IVOZBTMWTUAYTP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15103990

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.65

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.729

Distribution Coefficient, logD

4.729

Water Solubility, LogSw

-4.50

Polar Surface Area

69.427

Acid Dissociation Constant (pKa)

11.65

Base Dissociation Constant (pKb)

4.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

K788-2781 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Nervous system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with K788-2781 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K788-2781?
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What is the minimum amount of K788-2781 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K788-2781
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K788-2781
  • 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 K788-2781 available by request