1051-0193 Screening compound: benzyl 6-oxo-6-(1,4,7,10,13-pentaoxa-16-azacyclooctadecan-16-yl)hexanoate

1051-0193 Screening compound: benzyl 6-oxo-6-(1,4,7,10,13-pentaoxa-16-azacyclooctadecan-16-yl)hexanoate
1051-0193 Screening compound: benzyl 6-oxo-6-(1,4,7,10,13-pentaoxa-16-azacyclooctadecan-16-yl)hexanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1051-0193
benzyl 6-oxo-6-(1,4,7,10,13-pentaoxa-16-azacyclooctadecan-16-yl)hexanoate

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

1051-0193

Molecular Formula

C25H39NO8 (C25 H39 NO8)

Compound Name

benzyl 6-oxo-6-(1,4,7,10,13-pentaoxa-16-azacyclooctadecan-16-yl)hexanoate

IUPAC name

benzyl 6-oxo-6-(1471013-pentaoxa-16-azacyclooctadecan-16-yl)hexanoate

SMILES

O=C(CCCCC(OCc1ccccc1)=O)N1CCOCCOCCOCCOCCOCC1

InChI

InChI=1S/C25H39NO8/c27-24(8-4-5-9-25(28)34-22-23-6-2-1-3-7-23)26-10-12-29-14-16-31-18-20-33-21-19-32-17-15-30-13-11-26/h1-3,6-7H,4-5,8-22H2

InChI Key

NGLDHACGJDYHPZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00321253

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

481.59

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.975

Distribution Coefficient, logD

0.975

Water Solubility, LogSw

-1.24

Polar Surface Area

76.767

Acid Dissociation Constant (pKa)

23.20

Base Dissociation Constant (pKb)

-0.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

68.00

References: we are preparing a list of scientific research reports with 1051-0193 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1051-0193?
Check Price and Availability of 1051-0193, 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 1051-0193 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1051-0193
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1051-0193
  • 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 1051-0193 available by request