K784-3631 Screening compound: 2-{2-chloro-N-[(4-chlorophenyl)methyl]acetamido}-2-(4-chlorophenyl)-N-cyclohexylacetamide

K784-3631 Screening compound: 2-{2-chloro-N-[(4-chlorophenyl)methyl]acetamido}-2-(4-chlorophenyl)-N-cyclohexylacetamide
K784-3631 Screening compound: 2-{2-chloro-N-[(4-chlorophenyl)methyl]acetamido}-2-(4-chlorophenyl)-N-cyclohexylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-3631
2-{2-chloro-N-[(4-chlorophenyl)methyl]acetamido}-2-(4-chlorophenyl)-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

K784-3631

Molecular Formula

C23H25Cl3N2O2 (C23 H25 Cl3 N2 O2)

Compound Name

2-{2-chloro-N-[(4-chlorophenyl)methyl]acetamido}-2-(4-chlorophenyl)-N-cyclohexylacetamide

IUPAC name

2-{2-chloro-N-[(4-chlorophenyl)methyl]acetamido}-2-(4-chlorophenyl)-N-cyclohexylacetamide

SMILES

O=C(CCl)N(Cc(cc1)ccc1Cl)C(C(NC1CCCCC1)=O)c(cc1)ccc1Cl

InChI

InChI=1S/C23H25Cl3N2O2/c24-14-21(29)28(15-16-6-10-18(25)11-7-16)22(17-8-12-19(26)13-9-17)23(30)27-20-4-2-1-3-5-20/h6-13,20,22H,1-5,14-15H2,(H,27,30)/t22-/m1/s1

InChI Key

XCXWZTDYKNDBPN-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD03450869

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.82

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.485

Distribution Coefficient, logD

5.485

Water Solubility, LogSw

-6.24

Polar Surface Area

39.045

Acid Dissociation Constant (pKa)

14.63

Base Dissociation Constant (pKb)

2.21

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.10

K784-3631 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with K784-3631 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-3631?
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What is the minimum amount of K784-3631 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-3631
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-3631
  • 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 K784-3631 available by request