E975-1628 Screening compound: 7-(morpholine-4-sulfonyl)-2,3,4,5-tetrahydro-1,5-benzothiazepin-4-one

E975-1628 Screening compound: 7-(morpholine-4-sulfonyl)-2,3,4,5-tetrahydro-1,5-benzothiazepin-4-one
E975-1628 Screening compound: 7-(morpholine-4-sulfonyl)-2,3,4,5-tetrahydro-1,5-benzothiazepin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E975-1628
7-(morpholine-4-sulfonyl)-2,3,4,5-tetrahydro-1,5-benzothiazepin-4-one

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

E975-1628

Molecular Formula

C13H16N2O4S2 (C13 H16 N2 O4 S2)

Compound Name

7-(morpholine-4-sulfonyl)-2,3,4,5-tetrahydro-1,5-benzothiazepin-4-one

IUPAC name

7-(morpholine-4-sulfonyl)-2345-tetrahydro-15-benzothiazepin-4-one

SMILES

O=C1Nc(cc(cc2)S(N3CCOCC3)(=O)=O)c2SCC1

InChI

InChI=1S/C13H16N2O4S2/c16-13-3-8-20-12-2-1-10(9-11(12)14-13)21(17,18)15-4-6-19-7-5-15/h1-2,9H,3-8H2,(H,14,16)

InChI Key

VDPKIIZBBCBZHJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD13760344

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.41

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.894

Distribution Coefficient, logD

0.894

Water Solubility, LogSw

-2.42

Polar Surface Area

65.010

Acid Dissociation Constant (pKa)

10.62

Base Dissociation Constant (pKb)

-3.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

E975-1628 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

CNS MPO Library (28609 compounds)

Protein-Protein Interaction Library (218420 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Akt-Targeted Library (14764 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
  • GPCR
  • Kinases
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with E975-1628 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E975-1628?
Check Price and Availability of E975-1628, 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 E975-1628 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E975-1628
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E975-1628
  • 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 E975-1628 available by request