8006-7487 Screening compound: N-[4-(4-methoxyphenyl)-5-(4-nitrophenyl)-1,3-thiazol-2-yl]-4-nitrobenzamide

8006-7487 Screening compound: N-[4-(4-methoxyphenyl)-5-(4-nitrophenyl)-1,3-thiazol-2-yl]-4-nitrobenzamide
8006-7487 Screening compound: N-[4-(4-methoxyphenyl)-5-(4-nitrophenyl)-1,3-thiazol-2-yl]-4-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-7487
N-[4-(4-methoxyphenyl)-5-(4-nitrophenyl)-1,3-thiazol-2-yl]-4-nitrobenzamide

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

8006-7487

Molecular Formula

C23H16N4O6S (C23 H16 N4 O6 S)

Compound Name

N-[4-(4-methoxyphenyl)-5-(4-nitrophenyl)-1,3-thiazol-2-yl]-4-nitrobenzamide

IUPAC name

N-[4-(4-methoxyphenyl)-5-(4-nitrophenyl)-13-thiazol-2-yl]-4-nitrobenzamide

SMILES

COc(cc1)ccc1-c1c(-c(cc2)ccc2[N+]([O-])=O)sc(NC(c(cc2)ccc2[N+]([O-])=O)=O)n1

InChI

InChI=1S/C23H16N4O6S/c1-33-19-12-6-14(7-13-19)20-21(15-2-8-17(9-3-15)26(29)30)34-23(24-20)25-22(28)16-4-10-18(11-5-16)27(31)32/h2-13H,1H3,(H,24,25,28)

InChI Key

OZLBBLLKSTVMOL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00826476

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.47

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

5.771

Distribution Coefficient, logD

5.771

Water Solubility, LogSw

-5.52

Polar Surface Area

107.910

Acid Dissociation Constant (pKa)

11.58

Base Dissociation Constant (pKb)

-0.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

References: we are preparing a list of scientific research reports with 8006-7487 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-7487?
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What is the minimum amount of 8006-7487 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-7487
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-7487
  • 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 8006-7487 available by request