0389-0829 Screening compound: 4-butoxy-N-[4'-(4-butoxybenzamido)-3,3'-dimethoxy-[1,1'-biphenyl]-4-yl]benzamide

0389-0829 Screening compound: 4-butoxy-N-[4'-(4-butoxybenzamido)-3,3'-dimethoxy-[1,1'-biphenyl]-4-yl]benzamide
0389-0829 Screening compound: 4-butoxy-N-[4'-(4-butoxybenzamido)-3,3'-dimethoxy-[1,1'-biphenyl]-4-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0389-0829
4-butoxy-N-[4'-(4-butoxybenzamido)-3,3'-dimethoxy-[1,1'-biphenyl]-4-yl]benzamide

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

0389-0829

Molecular Formula

C36H40N2O6 (C36 H40 N2 O6)

Compound Name

4-butoxy-N-[4'-(4-butoxybenzamido)-3,3'-dimethoxy-[1,1'-biphenyl]-4-yl]benzamide

IUPAC name

4-butoxy-N-[4'-(4-butoxybenzamido)-33'-dimethoxy-[11'-biphenyl]-4-yl]benzamide

SMILES

CCCCOc(cc1)ccc1C(Nc(ccc(-c(cc1)cc(OC)c1NC(c(cc1)ccc1OCCCC)=O)c1)c1OC)=O

InChI

InChI=1S/C36H40N2O6/c1-5-7-21-43-29-15-9-25(10-16-29)35(39)37-31-19-13-27(23-33(31)41-3)28-14-20-32(34(24-28)42-4)38-36(40)26-11-17-30(18-12-26)44-22-8-6-2/h9-20,23-24H,5-8,21-22H2,1-4H3,(H,37,39)(H,38,40)

InChI Key

TWWBXESYDPGQCN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00985613

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

596.72

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

17.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

8.723

Distribution Coefficient, logD

8.723

Water Solubility, LogSw

-5.63

Polar Surface Area

74.850

Acid Dissociation Constant (pKa)

10.26

Base Dissociation Constant (pKb)

-2.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

0389-0829 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Regenerative Medicine Focused Library (23016 compounds)

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

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 0389-0829 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0389-0829?
Check Price and Availability of 0389-0829, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 0389-0829 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0389-0829
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0389-0829
  • 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 0389-0829 available by request