1831-1137 Screening compound: N-{3,3'-dimethoxy-4'-[2-(4-nitrophenyl)acetamido]-[1,1'-biphenyl]-4-yl}-2-(4-nitrophenyl)acetamide

1831-1137 Screening compound: N-{3,3'-dimethoxy-4'-[2-(4-nitrophenyl)acetamido]-[1,1'-biphenyl]-4-yl}-2-(4-nitrophenyl)acetamide
1831-1137 Screening compound: N-{3,3'-dimethoxy-4'-[2-(4-nitrophenyl)acetamido]-[1,1'-biphenyl]-4-yl}-2-(4-nitrophenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1831-1137
N-{3,3'-dimethoxy-4'-[2-(4-nitrophenyl)acetamido]-[1,1'-biphenyl]-4-yl}-2-(4-nitrophenyl)acetamide

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

1831-1137

Molecular Formula

C30H26N4O8 (C30 H26 N4 O8)

Compound Name

N-{3,3'-dimethoxy-4'-[2-(4-nitrophenyl)acetamido]-[1,1'-biphenyl]-4-yl}-2-(4-nitrophenyl)acetamide

IUPAC name

N-{33'-dimethoxy-4'-[2-(4-nitrophenyl)acetamido]-[11'-biphenyl]-4-yl}-2-(4-nitrophenyl)acetamide

SMILES

COc(cc(cc1)-c(cc2)cc(OC)c2NC(Cc(cc2)ccc2[N+]([O-])=O)=O)c1NC(Cc(cc1)ccc1[N+]([O-])=O)=O

InChI

InChI=1S/C30H26N4O8/c1-41-27-17-21(7-13-25(27)31-29(35)15-19-3-9-23(10-4-19)33(37)38)22-8-14-26(28(18-22)42-2)32-30(36)16-20-5-11-24(12-6-20)34(39)40/h3-14,17-18H,15-16H2,1-2H3,(H,31,35)(H,32,36)

InChI Key

LIFZZXUKJJXUIE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00584869

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

570.56

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

5.091

Distribution Coefficient, logD

5.091

Water Solubility, LogSw

-4.93

Polar Surface Area

126.351

Acid Dissociation Constant (pKa)

10.84

Base Dissociation Constant (pKb)

0.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

1831-1137 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 1831-1137 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1831-1137?
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What is the minimum amount of 1831-1137 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1831-1137
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1831-1137
  • 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 1831-1137 available by request