1682-8206 Screening compound: 2-({2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetohydrazido}carbonyl)benzoic acid

1682-8206 Screening compound: 2-({2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetohydrazido}carbonyl)benzoic acid
1682-8206 Screening compound: 2-({2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetohydrazido}carbonyl)benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 1682-8206
2-({2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetohydrazido}carbonyl)benzoic acid

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

1682-8206

Molecular Formula

C24H30N2O5 (C24 H30 N2 O5)

Compound Name

2-({2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetohydrazido}carbonyl)benzoic acid

IUPAC name

2-({2-[4-(244-trimethylpentan-2-yl)phenoxy]acetohydrazido}carbonyl)benzoic acid

SMILES

CC(C)(C)CC(C)(C)c(cc1)ccc1OCC(NNC(c(cccc1)c1C(O)=O)=O)=O

InChI

InChI=1S/C24H30N2O5/c1-23(2,3)15-24(4,5)16-10-12-17(13-11-16)31-14-20(27)25-26-21(28)18-8-6-7-9-19(18)22(29)30/h6-13H,14-15H2,1-5H3,(H,25,27)(H,26,28)(H,29,30)

InChI Key

RDCAPEAERSNBNF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00705233

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

426.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.456

Distribution Coefficient, logD

0.730

Water Solubility, LogSw

-4.23

Polar Surface Area

87.129

Acid Dissociation Constant (pKa)

3.67

Base Dissociation Constant (pKb)

0.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

1682-8206 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with 1682-8206 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1682-8206?
Check Price and Availability of 1682-8206, 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 1682-8206 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1682-8206
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1682-8206
  • 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 1682-8206 available by request