C163-0324 Screening compound: N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide

C163-0324 Screening compound: N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
C163-0324 Screening compound: N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C163-0324
N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide

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

C163-0324

Molecular Formula

C19H20Cl2N6O3 (C19 H20 Cl2 N6 O3)

Compound Name

N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide

IUPAC name

N-{1-[(24-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-4-(35-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide

SMILES

Cc(n(CCCC(Nc1cn(Cc(ccc(Cl)c2)c2Cl)nc1)=O)nc1C)c1[N+]([O-])=O

InChI

InChI=1S/C19H20Cl2N6O3/c1-12-19(27(29)30)13(2)26(24-12)7-3-4-18(28)23-16-9-22-25(11-16)10-14-5-6-15(20)8-17(14)21/h5-6,8-9,11H,3-4,7,10H2,1-2H3,(H,23,28)

InChI Key

IRPQNYHEENFYQW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06164503

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.31

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.571

Distribution Coefficient, logD

2.571

Water Solubility, LogSw

-3.42

Polar Surface Area

84.933

Acid Dissociation Constant (pKa)

10.12

Base Dissociation Constant (pKb)

-0.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

References: we are preparing a list of scientific research reports with C163-0324 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C163-0324?
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What is the minimum amount of C163-0324 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C163-0324
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C163-0324
  • 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 C163-0324 available by request