E918-0389 Screening compound: N6-(2,4-dimethylphenyl)-5-methyl-N3-(4-methylphenyl)-7-(2-nitrophenyl)-4H,7H-pyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide

E918-0389 Screening compound: N6-(2,4-dimethylphenyl)-5-methyl-N3-(4-methylphenyl)-7-(2-nitrophenyl)-4H,7H-pyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide
E918-0389 Screening compound: N6-(2,4-dimethylphenyl)-5-methyl-N3-(4-methylphenyl)-7-(2-nitrophenyl)-4H,7H-pyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E918-0389
N6-(2,4-dimethylphenyl)-5-methyl-N3-(4-methylphenyl)-7-(2-nitrophenyl)-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

E918-0389

Molecular Formula

C30H28N6O4 (C30 H28 N6 O4)

Compound Name

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

IUPAC name

N6-(24-dimethylphenyl)-5-methyl-N3-(4-methylphenyl)-7-(2-nitrophenyl)-4H7H-pyrazolo[15-a]pyrimidine-36-dicarboxamide

SMILES

Cc(cc1)ccc1NC(c1c(NC(C)=C(C2c(cccc3)c3[N+]([O-])=O)C(Nc3c(C)cc(C)cc3)=O)n2nc1)=O

InChI

InChI=1S/C30H28N6O4/c1-17-9-12-21(13-10-17)33-29(37)23-16-31-35-27(22-7-5-6-8-25(22)36(39)40)26(20(4)32-28(23)35)30(38)34-24-14-11-18(2)15-19(24)3/h5-16,27,32H,1-4H3,(H,33,37)(H,34,38)/t27-/m0/s1

InChI Key

JNVVNKIFKHAWLH-MHZLTWQESA-N

MDL Number (MFCD)

MFCD14927796

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

536.59

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

5.638

Distribution Coefficient, logD

5.636

Water Solubility, LogSw

-5.32

Polar Surface Area

102.729

Acid Dissociation Constant (pKa)

10.02

Base Dissociation Constant (pKb)

4.05

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with E918-0389 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E918-0389?
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What is the minimum amount of E918-0389 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E918-0389
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E918-0389
  • 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 E918-0389 available by request