S768-0320 Screening compound: 1-(2-methoxyethyl)-9-(morpholine-4-carbonyl)-2,3,4,5,6,7-hexahydro-1H-1-benzazonin-7-ol

S768-0320 Screening compound: 1-(2-methoxyethyl)-9-(morpholine-4-carbonyl)-2,3,4,5,6,7-hexahydro-1H-1-benzazonin-7-ol
S768-0320 Screening compound: 1-(2-methoxyethyl)-9-(morpholine-4-carbonyl)-2,3,4,5,6,7-hexahydro-1H-1-benzazonin-7-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound S768-0320
1-(2-methoxyethyl)-9-(morpholine-4-carbonyl)-2,3,4,5,6,7-hexahydro-1H-1-benzazonin-7-ol

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

S768-0320

Molecular Formula

C20H30N2O4 (C20 H30 N2 O4)

Compound Name

1-(2-methoxyethyl)-9-(morpholine-4-carbonyl)-2,3,4,5,6,7-hexahydro-1H-1-benzazonin-7-ol

IUPAC name

1-(2-methoxyethyl)-9-(morpholine-4-carbonyl)-234567-hexahydro-1H-1-benzazonin-7-ol

SMILES

COCCN(CCCCCC1O)c(cc2)c1cc2C(N1CCOCC1)=O

InChI

InChI=1S/C20H30N2O4/c1-25-12-9-21-8-4-2-3-5-19(23)17-15-16(6-7-18(17)21)20(24)22-10-13-26-14-11-22/h6-7,15,19,23H,2-5,8-14H2,1H3/t19-/m0/s1

InChI Key

MJPHXKMVXYDKKJ-IBGZPJMESA-N

MDL Number (MFCD)

MFCD30464489

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.767

Distribution Coefficient, logD

1.766

Water Solubility, LogSw

-2.29

Polar Surface Area

51.897

Acid Dissociation Constant (pKa)

14.90

Base Dissociation Constant (pKb)

3.93

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

65.00

S768-0320 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Anti-infective Library (19449 compounds)

CNS BBB Library (22607 compounds)

Macrocycles Library (2450 compounds)

Protein-Protein Interaction Library (218420 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds
  • Mimetics
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with S768-0320 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S768-0320?
Check Price and Availability of S768-0320, 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 S768-0320 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S768-0320
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S768-0320
  • 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 S768-0320 available by request