E977-0296 Screening compound: N-(3-chloro-4-methylphenyl)-2-(N-methyl2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonamido)acetamide

E977-0296 Screening compound: N-(3-chloro-4-methylphenyl)-2-(N-methyl2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonamido)acetamide
E977-0296 Screening compound: N-(3-chloro-4-methylphenyl)-2-(N-methyl2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonamido)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E977-0296
N-(3-chloro-4-methylphenyl)-2-(N-methyl2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonamido)acetamide

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

E977-0296

Molecular Formula

C20H22ClN3O4S (C20 H22 ClN3 O4 S)

Compound Name

N-(3-chloro-4-methylphenyl)-2-(N-methyl2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonamido)acetamide

IUPAC name

N-(3-chloro-4-methylphenyl)-2-(N-methyl2-oxo-2345-tetrahydro-1H-1-benzazepine-7-sulfonamido)acetamide

SMILES

Cc(ccc(NC(CN(C)S(c(cc1)cc(CCC2)c1NC2=O)(=O)=O)=O)c1)c1Cl

InChI

InChI=1S/C20H22ClN3O4S/c1-13-6-7-15(11-17(13)21)22-20(26)12-24(2)29(27,28)16-8-9-18-14(10-16)4-3-5-19(25)23-18/h6-11H,3-5,12H2,1-2H3,(H,22,26)(H,23,25)

InChI Key

FBWBXGDDIUECQX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14934606

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.93

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.412

Distribution Coefficient, logD

3.410

Water Solubility, LogSw

-3.71

Polar Surface Area

81.104

Acid Dissociation Constant (pKa)

9.83

Base Dissociation Constant (pKb)

-0.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

E977-0296 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

SH2 Library (10483 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Therapeutical areas:
  • Cancer
  • Endocrine
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with E977-0296 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E977-0296?
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What is the minimum amount of E977-0296 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E977-0296
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E977-0296
  • 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 E977-0296 available by request