C700-1819 Screening compound: N-[2-(4-ethoxyphenyl)ethyl]-2,3-dimethyl-1-[(3-methylphenyl)methyl]-1H-indole-5-carboxamide

C700-1819 Screening compound: N-[2-(4-ethoxyphenyl)ethyl]-2,3-dimethyl-1-[(3-methylphenyl)methyl]-1H-indole-5-carboxamide
C700-1819 Screening compound: N-[2-(4-ethoxyphenyl)ethyl]-2,3-dimethyl-1-[(3-methylphenyl)methyl]-1H-indole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C700-1819
N-[2-(4-ethoxyphenyl)ethyl]-2,3-dimethyl-1-[(3-methylphenyl)methyl]-1H-indole-5-carboxamide

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

C700-1819

Molecular Formula

C29H32N2O2 (C29 H32 N2 O2)

Compound Name

N-[2-(4-ethoxyphenyl)ethyl]-2,3-dimethyl-1-[(3-methylphenyl)methyl]-1H-indole-5-carboxamide

IUPAC name

N-[2-(4-ethoxyphenyl)ethyl]-23-dimethyl-1-[(3-methylphenyl)methyl]-1H-indole-5-carboxamide

SMILES

CCOc1ccc(CCNC(c(cc2)cc3c2n(Cc2cc(C)ccc2)c(C)c3C)=O)cc1

InChI

InChI=1S/C29H32N2O2/c1-5-33-26-12-9-23(10-13-26)15-16-30-29(32)25-11-14-28-27(18-25)21(3)22(4)31(28)19-24-8-6-7-20(2)17-24/h6-14,17-18H,5,15-16,19H2,1-4H3,(H,30,32)

InChI Key

FQMHDIIBXSXCNI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14785665

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.59

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.202

Distribution Coefficient, logD

6.202

Water Solubility, LogSw

-5.54

Polar Surface Area

32.817

Acid Dissociation Constant (pKa)

14.05

Base Dissociation Constant (pKb)

-1.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.60

C700-1819 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

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 C700-1819 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C700-1819?
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What is the minimum amount of C700-1819 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C700-1819
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C700-1819
  • 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 C700-1819 available by request