1763-0594 Screening compound: N1,N4-bis(4-methyl-2-nitrophenyl)benzene-1,4-dicarboxamide

1763-0594 Screening compound: N1,N4-bis(4-methyl-2-nitrophenyl)benzene-1,4-dicarboxamide
1763-0594 Screening compound: N1,N4-bis(4-methyl-2-nitrophenyl)benzene-1,4-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1763-0594
N1,N4-bis(4-methyl-2-nitrophenyl)benzene-1,4-dicarboxamide

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

1763-0594

Molecular Formula

C22H18N4O6 (C22 H18 N4 O6)

Compound Name

N1,N4-bis(4-methyl-2-nitrophenyl)benzene-1,4-dicarboxamide

IUPAC name

N1N4-bis(4-methyl-2-nitrophenyl)benzene-14-dicarboxamide

SMILES

Cc(cc1)cc([N+]([O-])=O)c1NC(c(cc1)ccc1C(Nc(ccc(C)c1)c1[N+]([O-])=O)=O)=O

InChI

InChI=1S/C22H18N4O6/c1-13-3-9-17(19(11-13)25(29)30)23-21(27)15-5-7-16(8-6-15)22(28)24-18-10-4-14(2)12-20(18)26(31)32/h3-12H,1-2H3,(H,23,27)(H,24,28)

InChI Key

ILCZWDNGBWEAHK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00784271

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.41

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.825

Distribution Coefficient, logD

4.351

Water Solubility, LogSw

-4.64

Polar Surface Area

111.186

Acid Dissociation Constant (pKa)

7.10

Base Dissociation Constant (pKb)

-6.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

References: we are preparing a list of scientific research reports with 1763-0594 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1763-0594?
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What is the minimum amount of 1763-0594 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1763-0594
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1763-0594
  • 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 1763-0594 available by request