8004-0030 Screening compound: N-(sec-butyl)-3-[(E)-2-(3-chloro-4-nitrobenzoyl)hydrazono]butanamide

8004-0030 Screening compound: N-(sec-butyl)-3-[(E)-2-(3-chloro-4-nitrobenzoyl)hydrazono]butanamide
8004-0030 Screening compound: N-(sec-butyl)-3-[(E)-2-(3-chloro-4-nitrobenzoyl)hydrazono]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-0030
N-(sec-butyl)-3-[(E)-2-(3-chloro-4-nitrobenzoyl)hydrazono]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

8004-0030

Molecular Formula

C15H19ClN4O4 (C15 H19 ClN4 O4)

Compound Name

N-(sec-butyl)-3-[(E)-2-(3-chloro-4-nitrobenzoyl)hydrazono]butanamide

IUPAC name

(3E)-N-(butan-2-yl)-3-{[(3-chloro-4-nitrophenyl)formamido]imino}butanamide

SMILES

CCC(C)NC(C/C(/C)=N/NC(c(cc1)cc(Cl)c1[N+]([O-])=O)=O)=O

InChI

InChI=1S/C15H19ClN4O4/c1-4-9(2)17-14(21)7-10(3)18-19-15(22)11-5-6-13(20(23)24)12(16)8-11/h5-6,8-9H,4,7H2,1-3H3,(H,17,21)(H,19,22)/t9-/m0/s1

InChI Key

JZICTIRQIQRTQI-VIFPVBQESA-N

MDL Number (MFCD)

MFCD00745226

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.79

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.222

Distribution Coefficient, logD

2.125

Water Solubility, LogSw

-3.44

Polar Surface Area

92.188

Acid Dissociation Constant (pKa)

8.00

Base Dissociation Constant (pKb)

2.22

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with 8004-0030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-0030?
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What is the minimum amount of 8004-0030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-0030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-0030
  • 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 8004-0030 available by request