E918-0334 Screening compound: 7-(2-chlorophenyl)-N6-(2-methoxyphenyl)-5-methyl-N3-(4-methylphenyl)-4H,7H-pyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide

E918-0334 Screening compound: 7-(2-chlorophenyl)-N6-(2-methoxyphenyl)-5-methyl-N3-(4-methylphenyl)-4H,7H-pyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide
E918-0334 Screening compound: 7-(2-chlorophenyl)-N6-(2-methoxyphenyl)-5-methyl-N3-(4-methylphenyl)-4H,7H-pyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E918-0334
7-(2-chlorophenyl)-N6-(2-methoxyphenyl)-5-methyl-N3-(4-methylphenyl)-4H,7H-pyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide

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

E918-0334

Molecular Formula

C29H26ClN5O3 (C29 H26 ClN5 O3)

Compound Name

7-(2-chlorophenyl)-N6-(2-methoxyphenyl)-5-methyl-N3-(4-methylphenyl)-4H,7H-pyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide

IUPAC name

7-(2-chlorophenyl)-N6-(2-methoxyphenyl)-5-methyl-N3-(4-methylphenyl)-4H7H-pyrazolo[15-a]pyrimidine-36-dicarboxamide

SMILES

Cc(cc1)ccc1NC(c1c(NC(C)=C(C2c(cccc3)c3Cl)C(Nc(cccc3)c3OC)=O)n2nc1)=O

InChI

InChI=1S/C29H26ClN5O3/c1-17-12-14-19(15-13-17)33-28(36)21-16-31-35-26(20-8-4-5-9-22(20)30)25(18(2)32-27(21)35)29(37)34-23-10-6-7-11-24(23)38-3/h4-16,26,32H,1-3H3,(H,33,36)(H,34,37)/t26-/m0/s1

InChI Key

FJRVQNQTKOVEQN-SANMLTNESA-N

MDL Number (MFCD)

MFCD14927763

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

528.01

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.667

Distribution Coefficient, logD

5.666

Water Solubility, LogSw

-5.88

Polar Surface Area

77.279

Acid Dissociation Constant (pKa)

10.18

Base Dissociation Constant (pKb)

3.56

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.80

E918-0334 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Neuropeptide S Library (2850 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Digestive system
  • Nervous system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E918-0334 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E918-0334?
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What is the minimum amount of E918-0334 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E918-0334
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E918-0334
  • 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 E918-0334 available by request