C202-4128 Screening compound: methyl 7-(3,4-dimethoxyphenyl)-5-methyl-6-[(2-methylphenyl)carbamoyl]-4H,7H-pyrazolo[1,5-a]pyrimidine-3-carboxylate

C202-4128 Screening compound: methyl 7-(3,4-dimethoxyphenyl)-5-methyl-6-[(2-methylphenyl)carbamoyl]-4H,7H-pyrazolo[1,5-a]pyrimidine-3-carboxylate
C202-4128 Screening compound: methyl 7-(3,4-dimethoxyphenyl)-5-methyl-6-[(2-methylphenyl)carbamoyl]-4H,7H-pyrazolo[1,5-a]pyrimidine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C202-4128
methyl 7-(3,4-dimethoxyphenyl)-5-methyl-6-[(2-methylphenyl)carbamoyl]-4H,7H-pyrazolo[1,5-a]pyrimidine-3-carboxylate

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

C202-4128

Molecular Formula

C25H26N4O5 (C25 H26 N4 O5)

Compound Name

methyl 7-(3,4-dimethoxyphenyl)-5-methyl-6-[(2-methylphenyl)carbamoyl]-4H,7H-pyrazolo[1,5-a]pyrimidine-3-carboxylate

IUPAC name

methyl 7-(34-dimethoxyphenyl)-5-methyl-6-[(2-methylphenyl)carbamoyl]-4H7H-pyrazolo[15-a]pyrimidine-3-carboxylate

SMILES

Cc(cccc1)c1NC(C(C(c(cc1)cc(OC)c1OC)n1nc2)=C(C)Nc1c2C(OC)=O)=O

InChI

InChI=1S/C25H26N4O5/c1-14-8-6-7-9-18(14)28-24(30)21-15(2)27-23-17(25(31)34-5)13-26-29(23)22(21)16-10-11-19(32-3)20(12-16)33-4/h6-13,22,27H,1-5H3,(H,28,30)/t22-/m0/s1

InChI Key

DRKGJEZZWBKRTL-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD14731878

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.359

Distribution Coefficient, logD

3.085

Water Solubility, LogSw

-3.53

Polar Surface Area

82.992

Acid Dissociation Constant (pKa)

7.46

Base Dissociation Constant (pKb)

-3.64

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

24.00

C202-4128 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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 C202-4128 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C202-4128?
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What is the minimum amount of C202-4128 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C202-4128
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C202-4128
  • 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 C202-4128 available by request