C163-0133 Screening compound: N-(5-chloro-2-methoxyphenyl)-4-(5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide

C163-0133 Screening compound: N-(5-chloro-2-methoxyphenyl)-4-(5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide
C163-0133 Screening compound: N-(5-chloro-2-methoxyphenyl)-4-(5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C163-0133
N-(5-chloro-2-methoxyphenyl)-4-(5-methyl-3-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

C163-0133

Molecular Formula

C15H17ClN4O4 (C15 H17 ClN4 O4)

Compound Name

N-(5-chloro-2-methoxyphenyl)-4-(5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide

IUPAC name

N-(5-chloro-2-methoxyphenyl)-4-(5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide

SMILES

Cc1cc([N+]([O-])=O)nn1CCCC(Nc(cc(cc1)Cl)c1OC)=O

InChI

InChI=1S/C15H17ClN4O4/c1-10-8-14(20(22)23)18-19(10)7-3-4-15(21)17-12-9-11(16)5-6-13(12)24-2/h5-6,8-9H,3-4,7H2,1-2H3,(H,17,21)

InChI Key

RGHIDVCAEHGKBH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14723410

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.78

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.424

Distribution Coefficient, logD

1.404

Water Solubility, LogSw

-2.78

Polar Surface Area

77.073

Acid Dissociation Constant (pKa)

8.72

Base Dissociation Constant (pKb)

0.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with C163-0133 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C163-0133?
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What is the minimum amount of C163-0133 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C163-0133
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C163-0133
  • 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 C163-0133 available by request