8016-4903 Screening compound: 2-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}-N-(3,4,5-trimethoxyphenyl)acetamide

8016-4903 Screening compound: 2-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}-N-(3,4,5-trimethoxyphenyl)acetamide
8016-4903 Screening compound: 2-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}-N-(3,4,5-trimethoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-4903
2-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}-N-(3,4,5-trimethoxyphenyl)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

8016-4903

Molecular Formula

C17H22N4O6S (C17 H22 N4 O6 S)

Compound Name

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

IUPAC name

2-{[4-(morpholin-4-yl)-125-thiadiazol-3-yl]oxy}-N-(345-trimethoxyphenyl)acetamide

SMILES

COc1cc(NC(COc2nsnc2N2CCOCC2)=O)cc(OC)c1OC

InChI

InChI=1S/C17H22N4O6S/c1-23-12-8-11(9-13(24-2)15(12)25-3)18-14(22)10-27-17-16(19-28-20-17)21-4-6-26-7-5-21/h8-9H,4-7,10H2,1-3H3,(H,18,22)

InChI Key

PUZRDTKJSBJNME-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05856808

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.45

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.101

Distribution Coefficient, logD

2.101

Water Solubility, LogSw

-2.91

Polar Surface Area

86.126

Acid Dissociation Constant (pKa)

10.41

Base Dissociation Constant (pKb)

3.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.06

8016-4903 in Drug Discovery

Included in Screening Libraries

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 8016-4903 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-4903?
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What is the minimum amount of 8016-4903 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-4903
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-4903
  • 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 8016-4903 available by request