8016-8900 Screening compound: 2-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}-N-[4-(morpholine-4-carbonyl)phenyl]acetamide

8016-8900 Screening compound: 2-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}-N-[4-(morpholine-4-carbonyl)phenyl]acetamide
8016-8900 Screening compound: 2-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}-N-[4-(morpholine-4-carbonyl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-8900
2-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}-N-[4-(morpholine-4-carbonyl)phenyl]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

8016-8900

Molecular Formula

C19H23N5O5S (C19 H23 N5 O5 S)

Compound Name

2-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}-N-[4-(morpholine-4-carbonyl)phenyl]acetamide

IUPAC name

2-{[4-(morpholin-4-yl)-125-thiadiazol-3-yl]oxy}-N-[4-(morpholine-4-carbonyl)phenyl]acetamide

SMILES

O=C(COc1nsnc1N1CCOCC1)Nc(cc1)ccc1C(N1CCOCC1)=O

InChI

InChI=1S/C19H23N5O5S/c25-16(13-29-18-17(21-30-22-18)23-5-9-27-10-6-23)20-15-3-1-14(2-4-15)19(26)24-7-11-28-12-8-24/h1-4H,5-13H2,(H,20,25)

InChI Key

NSPMLEHLMZHFRD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05860041

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.49

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.474

Distribution Coefficient, logD

1.474

Water Solubility, LogSw

-2.28

Polar Surface Area

87.704

Acid Dissociation Constant (pKa)

10.50

Base Dissociation Constant (pKb)

-0.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.37

8016-8900 in Drug Discovery

Included in Screening Libraries

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

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8016-8900 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-8900?
Check Price and Availability of 8016-8900, 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 8016-8900 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-8900
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-8900
  • 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 8016-8900 available by request