8007-1055 Screening compound: N-cyclohexyl-N-{2-[(dibenzo[b,d]furan-3-ylimino)methyl]-4-nitrophenyl}-N-methylamine

8007-1055 Screening compound: N-cyclohexyl-N-{2-[(dibenzo[b,d]furan-3-ylimino)methyl]-4-nitrophenyl}-N-methylamine
8007-1055 Screening compound: N-cyclohexyl-N-{2-[(dibenzo[b,d]furan-3-ylimino)methyl]-4-nitrophenyl}-N-methylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-1055
N-cyclohexyl-N-{2-[(dibenzo[b,d]furan-3-ylimino)methyl]-4-nitrophenyl}-N-methylamine

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

8007-1055

Molecular Formula

C26H25N3O3 (C26 H25 N3 O3)

Compound Name

N-cyclohexyl-N-{2-[(dibenzo[b,d]furan-3-ylimino)methyl]-4-nitrophenyl}-N-methylamine

IUPAC name

N-cyclohexyl-N-methyl-4-nitro-2-[(E)-({8-oxatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)351012-hexaen-5-yl}imino)methyl]aniline

SMILES

CN(C1CCCCC1)c(cc1)c(/C=N/c(cc2)cc3c2c(cccc2)c2o3)cc1[N+]([O-])=O

InChI

InChI=1S/C26H25N3O3/c1-28(20-7-3-2-4-8-20)24-14-12-21(29(30)31)15-18(24)17-27-19-11-13-23-22-9-5-6-10-25(22)32-26(23)16-19/h5-6,9-17,20H,2-4,7-8H2,1H3

InChI Key

UGFITLSNCZNJIC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00754838

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

7.145

Distribution Coefficient, logD

7.145

Water Solubility, LogSw

-5.98

Polar Surface Area

51.368

Acid Dissociation Constant (pKa)

26.57

Base Dissociation Constant (pKb)

2.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

References: we are preparing a list of scientific research reports with 8007-1055 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-1055?
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What is the minimum amount of 8007-1055 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-1055
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-1055
  • 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 8007-1055 available by request