D643-0037 Screening compound: 2-[3-(3,4-dimethoxyphenyl)-1H-pyrazol-5-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine

D643-0037 Screening compound: 2-[3-(3,4-dimethoxyphenyl)-1H-pyrazol-5-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
D643-0037 Screening compound: 2-[3-(3,4-dimethoxyphenyl)-1H-pyrazol-5-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound D643-0037
2-[3-(3,4-dimethoxyphenyl)-1H-pyrazol-5-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine

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

D643-0037

Molecular Formula

C23H19N7O2S (C23 H19 N7 O2 S)

Compound Name

2-[3-(3,4-dimethoxyphenyl)-1H-pyrazol-5-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine

IUPAC name

4-[3-(34-dimethoxyphenyl)-1H-pyrazol-5-yl]-1113-dimethyl-16-thia-356814-pentaazatetracyclo[7.7.0.0^{26}.0^{1015}]hexadeca-1(9)247101214-heptaene

SMILES

Cc1c(c(ncn2nc(-c3cc(-c(cc4)cc(OC)c4OC)n[nH]3)nc22)c2s2)c2nc(C)c1

InChI

InChI=1S/C23H19N7O2S/c1-11-7-12(2)25-23-18(11)19-20(33-23)22-26-21(29-30(22)10-24-19)15-9-14(27-28-15)13-5-6-16(31-3)17(8-13)32-4/h5-10H,1-4H3,(H,27,28)

InChI Key

FGEMBTCRTKXCPW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27595172

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.310

Distribution Coefficient, logD

4.164

Water Solubility, LogSw

-4.57

Polar Surface Area

77.778

Acid Dissociation Constant (pKa)

11.43

Base Dissociation Constant (pKb)

7.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

D643-0037 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D643-0037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D643-0037?
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What is the minimum amount of D643-0037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D643-0037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D643-0037
  • 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 D643-0037 available by request