C094-1595 Screening compound: N-cyclohexyl-2-[ethyl(3-methylphenyl)amino]-2-phenylacetamide

C094-1595 Screening compound: N-cyclohexyl-2-[ethyl(3-methylphenyl)amino]-2-phenylacetamide
C094-1595 Screening compound: N-cyclohexyl-2-[ethyl(3-methylphenyl)amino]-2-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C094-1595
N-cyclohexyl-2-[ethyl(3-methylphenyl)amino]-2-phenylacetamide

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

C094-1595

Molecular Formula

C23H30N2O (C23 H30 N2 O)

Compound Name

N-cyclohexyl-2-[ethyl(3-methylphenyl)amino]-2-phenylacetamide

IUPAC name

N-cyclohexyl-2-[ethyl(3-methylphenyl)amino]-2-phenylacetamide

SMILES

CCN(C(C(NC1CCCCC1)=O)c1ccccc1)c1cc(C)ccc1

InChI

InChI=1S/C23H30N2O/c1-3-25(21-16-10-11-18(2)17-21)22(19-12-6-4-7-13-19)23(26)24-20-14-8-5-9-15-20/h4,6-7,10-13,16-17,20,22H,3,5,8-9,14-15H2,1-2H3,(H,24,26)/t22-/m1/s1

InChI Key

XDFYBXHEMGEWMO-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD03449974

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.5

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.677

Distribution Coefficient, logD

5.677

Water Solubility, LogSw

-5.32

Polar Surface Area

26.101

Acid Dissociation Constant (pKa)

14.55

Base Dissociation Constant (pKb)

4.06

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.50

C094-1595 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with C094-1595 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C094-1595?
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What is the minimum amount of C094-1595 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C094-1595
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C094-1595
  • 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 C094-1595 available by request