E977-0368 Screening compound: N-(2,5-diethoxyphenyl)-2-(N-methyl2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonamido)acetamide

E977-0368 Screening compound: N-(2,5-diethoxyphenyl)-2-(N-methyl2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonamido)acetamide
E977-0368 Screening compound: N-(2,5-diethoxyphenyl)-2-(N-methyl2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonamido)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E977-0368
N-(2,5-diethoxyphenyl)-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

E977-0368

Molecular Formula

C23H29N3O6S (C23 H29 N3 O6 S)

Compound Name

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

IUPAC name

N-(25-diethoxyphenyl)-2-(N-methyl2-oxo-2345-tetrahydro-1H-1-benzazepine-7-sulfonamido)acetamide

SMILES

CCOc(cc1)cc(NC(CN(C)S(c(cc2)cc(CCC3)c2NC3=O)(=O)=O)=O)c1OCC

InChI

InChI=1S/C23H29N3O6S/c1-4-31-17-9-12-21(32-5-2)20(14-17)25-23(28)15-26(3)33(29,30)18-10-11-19-16(13-18)7-6-8-22(27)24-19/h9-14H,4-8,15H2,1-3H3,(H,24,27)(H,25,28)

InChI Key

ONPXMBYSTVBMEV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14934647

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.57

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.514

Distribution Coefficient, logD

2.510

Water Solubility, LogSw

-3.07

Polar Surface Area

94.740

Acid Dissociation Constant (pKa)

9.42

Base Dissociation Constant (pKb)

-0.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

E977-0368 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein-Protein Interaction Library (218420 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Recognition Elements PPI Library (24135 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with E977-0368 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E977-0368?
Check Price and Availability of E977-0368, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E977-0368 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E977-0368
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E977-0368
  • 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 E977-0368 available by request