1262-0232 Screening compound: benzyl 4-(dodecylcarbamoyl)-4-acetamidobutanoate

1262-0232 Screening compound: benzyl 4-(dodecylcarbamoyl)-4-acetamidobutanoate
1262-0232 Screening compound: benzyl 4-(dodecylcarbamoyl)-4-acetamidobutanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1262-0232
benzyl 4-(dodecylcarbamoyl)-4-acetamidobutanoate

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

1262-0232

Molecular Formula

C26H42N2O4 (C26 H42 N2 O4)

Compound Name

benzyl 4-(dodecylcarbamoyl)-4-acetamidobutanoate

IUPAC name

benzyl 4-(dodecylcarbamoyl)-4-acetamidobutanoate

SMILES

CCCCCCCCCCCCNC(C(CCC(OCc1ccccc1)=O)NC(C)=O)=O

InChI

InChI=1S/C26H42N2O4/c1-3-4-5-6-7-8-9-10-11-15-20-27-26(31)24(28-22(2)29)18-19-25(30)32-21-23-16-13-12-14-17-23/h12-14,16-17,24H,3-11,15,18-21H2,1-2H3,(H,27,31)(H,28,29)/t24-/m0/s1

InChI Key

ZFYRMQFKUCQZMW-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD01118946

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.63

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

21.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.279

Distribution Coefficient, logD

6.279

Water Solubility, LogSw

-5.18

Polar Surface Area

69.513

Acid Dissociation Constant (pKa)

14.58

Base Dissociation Constant (pKb)

1.41

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

65.40

1262-0232 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 1262-0232 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1262-0232?
Check Price and Availability of 1262-0232, 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 1262-0232 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1262-0232
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1262-0232
  • 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 1262-0232 available by request