8007-1962 Screening compound: 2-(2-{(E)-1-[4-(diisobutylamino)-3-nitrophenyl]methylidene}hydrazino)-N,N-diethyl-5-nitro-1-benzenesulfonamide

8007-1962 Screening compound: 2-(2-{(E)-1-[4-(diisobutylamino)-3-nitrophenyl]methylidene}hydrazino)-N,N-diethyl-5-nitro-1-benzenesulfonamide
8007-1962 Screening compound: 2-(2-{(E)-1-[4-(diisobutylamino)-3-nitrophenyl]methylidene}hydrazino)-N,N-diethyl-5-nitro-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-1962
2-(2-{(E)-1-[4-(diisobutylamino)-3-nitrophenyl]methylidene}hydrazino)-N,N-diethyl-5-nitro-1-benzenesulfonamide

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

8007-1962

Molecular Formula

C25H36N6O6S (C25 H36 N6 O6 S)

Compound Name

2-(2-{(E)-1-[4-(diisobutylamino)-3-nitrophenyl]methylidene}hydrazino)-N,N-diethyl-5-nitro-1-benzenesulfonamide

IUPAC name

2-[(2E)-2-({4-[bis(2-methylpropyl)amino]-3-nitrophenyl}methylidene)hydrazin-1-yl]-NN-diethyl-5-nitrobenzene-1-sulfonamide

SMILES

CCN(CC)S(c(cc(cc1)[N+]([O-])=O)c1N/N=C/c(cc1)cc([N+]([O-])=O)c1N(CC(C)C)CC(C)C)(=O)=O

InChI

InChI=1S/C25H36N6O6S/c1-7-29(8-2)38(36,37)25-14-21(30(32)33)10-11-22(25)27-26-15-20-9-12-23(24(13-20)31(34)35)28(16-18(3)4)17-19(5)6/h9-15,18-19,27H,7-8,16-17H2,1-6H3

InChI Key

OKSVCGDAIDTHDJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00754887

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

548.66

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

5.935

Distribution Coefficient, logD

5.935

Water Solubility, LogSw

-5.63

Polar Surface Area

121.222

Acid Dissociation Constant (pKa)

11.43

Base Dissociation Constant (pKb)

0.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.00

References: we are preparing a list of scientific research reports with 8007-1962 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-1962?
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What is the minimum amount of 8007-1962 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-1962
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-1962
  • 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 8007-1962 available by request