C301-5125 Screening compound: N-(5-chloro-2,4-dimethoxyphenyl)-3,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonamide

C301-5125 Screening compound: N-(5-chloro-2,4-dimethoxyphenyl)-3,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonamide
C301-5125 Screening compound: N-(5-chloro-2,4-dimethoxyphenyl)-3,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-5125
N-(5-chloro-2,4-dimethoxyphenyl)-3,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonamide

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

C301-5125

Molecular Formula

C16H16ClN3O5S2 (C16 H16 ClN3 O5 S2)

Compound Name

N-(5-chloro-2,4-dimethoxyphenyl)-3,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonamide

IUPAC name

N-(5-chloro-24-dimethoxyphenyl)-37-dimethyl-5-oxo-5H-[13]thiazolo[32-a]pyrimidine-6-sulfonamide

SMILES

CC(N1C2=O)=CSC1=NC(C)=C2S(Nc(c(OC)c1)cc(Cl)c1OC)(=O)=O

InChI

InChI=1S/C16H16ClN3O5S2/c1-8-7-26-16-18-9(2)14(15(21)20(8)16)27(22,23)19-11-5-10(17)12(24-3)6-13(11)25-4/h5-7,19H,1-4H3

InChI Key

UYQFMDKDEYPMPF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09696920

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.9

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.205

Distribution Coefficient, logD

-1.835

Water Solubility, LogSw

-3.11

Polar Surface Area

79.982

Acid Dissociation Constant (pKa)

3.36

Base Dissociation Constant (pKb)

-5.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

C301-5125 in Drug Discovery

Included in Screening Libraries

Purinergic Library (3321 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
  • Metabolic
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C301-5125 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-5125?
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What is the minimum amount of C301-5125 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-5125
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-5125
  • 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 C301-5125 available by request