C200-7235 Screening compound: 2-(2-chloro-6-fluorobenzyl)-4-(3,4-dimethoxyphenethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione

C200-7235 Screening compound: 2-(2-chloro-6-fluorobenzyl)-4-(3,4-dimethoxyphenethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
C200-7235 Screening compound: 2-(2-chloro-6-fluorobenzyl)-4-(3,4-dimethoxyphenethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-7235
2-(2-chloro-6-fluorobenzyl)-4-(3,4-dimethoxyphenethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione

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

C200-7235

Molecular Formula

C24H20ClFN4O4S (C24 H20 ClFN4 O4 S)

Compound Name

2-(2-chloro-6-fluorobenzyl)-4-(3,4-dimethoxyphenethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione

IUPAC name

11-[(2-chloro-6-fluorophenyl)methyl]-8-[2-(34-dimethoxyphenyl)ethyl]-5-thia-181011-tetraazatricyclo[7.3.0.0^{26}]dodeca-2(6)39-triene-712-dione

SMILES

COc(ccc(CCN(C(N1c2c3scc2)=NN(Cc(c(F)ccc2)c2Cl)C1=O)C3=O)c1)c1OC

InChI

InChI=1S/C24H20ClFN4O4S/c1-33-19-7-6-14(12-20(19)34-2)8-10-28-22(31)21-18(9-11-35-21)30-23(28)27-29(24(30)32)13-15-16(25)4-3-5-17(15)26/h3-7,9,11-12H,8,10,13H2,1-2H3

InChI Key

YOHOQXZCCNILSQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26962094

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

514.96

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.269

Distribution Coefficient, logD

4.269

Water Solubility, LogSw

-4.53

Polar Surface Area

64.193

Acid Dissociation Constant (pKa)

23.82

Base Dissociation Constant (pKb)

-1.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

C200-7235 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C200-7235 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-7235?
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What is the minimum amount of C200-7235 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-7235
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-7235
  • 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 C200-7235 available by request