1988-2044 Screening compound: N'-[2-(4-chloro-3,5-dimethylphenoxy)acetyl]-3-methylbenzohydrazide

1988-2044 Screening compound: N'-[2-(4-chloro-3,5-dimethylphenoxy)acetyl]-3-methylbenzohydrazide
1988-2044 Screening compound: N'-[2-(4-chloro-3,5-dimethylphenoxy)acetyl]-3-methylbenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1988-2044
N'-[2-(4-chloro-3,5-dimethylphenoxy)acetyl]-3-methylbenzohydrazide

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

1988-2044

Molecular Formula

C18H19ClN2O3 (C18 H19 ClN2 O3)

Compound Name

N'-[2-(4-chloro-3,5-dimethylphenoxy)acetyl]-3-methylbenzohydrazide

IUPAC name

N'-[2-(4-chloro-35-dimethylphenoxy)acetyl]-3-methylbenzohydrazide

SMILES

Cc1cccc(C(NNC(COc(cc2C)cc(C)c2Cl)=O)=O)c1

InChI

InChI=1S/C18H19ClN2O3/c1-11-5-4-6-14(7-11)18(23)21-20-16(22)10-24-15-8-12(2)17(19)13(3)9-15/h4-9H,10H2,1-3H3,(H,20,22)(H,21,23)

InChI Key

QIGLZODGVVBGEJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01071231

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.81

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.979

Distribution Coefficient, logD

3.964

Water Solubility, LogSw

-4.44

Polar Surface Area

58.720

Acid Dissociation Constant (pKa)

8.84

Base Dissociation Constant (pKb)

0.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

1988-2044 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 1988-2044 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1988-2044?
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What is the minimum amount of 1988-2044 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1988-2044
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1988-2044
  • 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 1988-2044 available by request