D369-0041 Screening compound: 8-bromo-3-butyl-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one

D369-0041 Screening compound: 8-bromo-3-butyl-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
D369-0041 Screening compound: 8-bromo-3-butyl-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D369-0041
8-bromo-3-butyl-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-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

D369-0041

Molecular Formula

C14H15BrN4OS (C14 H15 BrN4 OS)

Compound Name

8-bromo-3-butyl-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one

IUPAC name

12-bromo-5-butyl-1113-dimethyl-8-thia-34510-tetraazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)3911-pentaen-6-one

SMILES

CCCCN(C1=O)N=Nc(c2c3C)c1sc2nc(C)c3Br

InChI

InChI=1S/C14H15BrN4OS/c1-4-5-6-19-14(20)12-11(17-18-19)9-7(2)10(15)8(3)16-13(9)21-12/h4-6H2,1-3H3

InChI Key

AWNUKOBJEUWPIM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14825536

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.27

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.471

Distribution Coefficient, logD

4.471

Water Solubility, LogSw

-4.31

Polar Surface Area

49.228

Acid Dissociation Constant (pKa)

26.00

Base Dissociation Constant (pKb)

1.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

D369-0041 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D369-0041 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D369-0041?
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What is the minimum amount of D369-0041 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D369-0041
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D369-0041
  • 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 D369-0041 available by request