8007-9367 Screening compound: N-(2-chloro-5-{[4-(2,4-dipentylphenoxy)butanoyl]amino}phenyl)-4,4-dimethyl-3-oxopentanamide

8007-9367 Screening compound: N-(2-chloro-5-{[4-(2,4-dipentylphenoxy)butanoyl]amino}phenyl)-4,4-dimethyl-3-oxopentanamide
8007-9367 Screening compound: N-(2-chloro-5-{[4-(2,4-dipentylphenoxy)butanoyl]amino}phenyl)-4,4-dimethyl-3-oxopentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-9367
N-(2-chloro-5-{[4-(2,4-dipentylphenoxy)butanoyl]amino}phenyl)-4,4-dimethyl-3-oxopentanamide

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

8007-9367

Molecular Formula

C33H47ClN2O4 (C33 H47 ClN2 O4)

Compound Name

N-(2-chloro-5-{[4-(2,4-dipentylphenoxy)butanoyl]amino}phenyl)-4,4-dimethyl-3-oxopentanamide

IUPAC name

N-{2-chloro-5-[4-(24-dipentylphenoxy)butanamido]phenyl}-44-dimethyl-3-oxopentanamide

SMILES

CCCCCc(cc1)cc(CCCCC)c1OCCCC(Nc(cc1)cc(NC(CC(C(C)(C)C)=O)=O)c1Cl)=O

InChI

InChI=1S/C33H47ClN2O4/c1-6-8-10-13-24-16-19-29(25(21-24)14-11-9-7-2)40-20-12-15-31(38)35-26-17-18-27(34)28(22-26)36-32(39)23-30(37)33(3,4)5/h16-19,21-22H,6-15,20,23H2,1-5H3,(H,35,38)(H,36,39)

InChI Key

QWONUNJZTLUQCL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00226915

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

571.2

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

20.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

8.867

Distribution Coefficient, logD

8.865

Water Solubility, LogSw

-6.49

Polar Surface Area

66.319

Acid Dissociation Constant (pKa)

9.80

Base Dissociation Constant (pKb)

-0.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.54

8007-9367 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

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

Included in 1.7M Stock Database

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 8007-9367 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-9367?
Check Price and Availability of 8007-9367, 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 8007-9367 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-9367
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-9367
  • 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 8007-9367 available by request