8002-4740 Screening compound: 1-{2-[(E)-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]methyl]-4-nitrophenyl}-N,N-diethylpiperidine-3-carboxamide

8002-4740 Screening compound: 1-{2-[(E)-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]methyl]-4-nitrophenyl}-N,N-diethylpiperidine-3-carboxamide
8002-4740 Screening compound: 1-{2-[(E)-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]methyl]-4-nitrophenyl}-N,N-diethylpiperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-4740
1-{2-[(E)-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]methyl]-4-nitrophenyl}-N,N-diethylpiperidine-3-carboxamide

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

8002-4740

Molecular Formula

C23H27N7O7 (C23 H27 N7 O7)

Compound Name

1-{2-[(E)-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]methyl]-4-nitrophenyl}-N,N-diethylpiperidine-3-carboxamide

IUPAC name

1-{2-[(E)-[2-(24-dinitrophenyl)hydrazin-1-ylidene]methyl]-4-nitrophenyl}-NN-diethylpiperidine-3-carboxamide

SMILES

CCN(CC)C(C(CCC1)CN1c(cc1)c(/C=N/Nc(ccc([N+]([O-])=O)c2)c2[N+]([O-])=O)cc1[N+]([O-])=O)=O

InChI

InChI=1S/C23H27N7O7/c1-3-26(4-2)23(31)16-6-5-11-27(15-16)21-10-8-18(28(32)33)12-17(21)14-24-25-20-9-7-19(29(34)35)13-22(20)30(36)37/h7-10,12-14,16,25H,3-6,11,15H2,1-2H3/t16-/m0/s1

InChI Key

YSNPCMFNCVYWKI-INIZCTEOSA-N

MDL Number (MFCD)

MFCD00314184

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

513.51

Hydrogen Bond Acceptors Count

15.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

14

Partition Coefficient, logP

4.671

Distribution Coefficient, logD

4.671

Water Solubility, LogSw

-4.54

Polar Surface Area

139.538

Acid Dissociation Constant (pKa)

10.98

Base Dissociation Constant (pKb)

1.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.10

References: we are preparing a list of scientific research reports with 8002-4740 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-4740?
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What is the minimum amount of 8002-4740 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-4740
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-4740
  • 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 8002-4740 available by request