1051-0144 Screening compound: benzyl 5-{13-[5-(benzyloxy)-5-oxopentanoyl]-1,4,10-trioxa-7,13-diazacyclopentadecan-7-yl}-5-oxopentanoate

1051-0144 Screening compound: benzyl 5-{13-[5-(benzyloxy)-5-oxopentanoyl]-1,4,10-trioxa-7,13-diazacyclopentadecan-7-yl}-5-oxopentanoate
1051-0144 Screening compound: benzyl 5-{13-[5-(benzyloxy)-5-oxopentanoyl]-1,4,10-trioxa-7,13-diazacyclopentadecan-7-yl}-5-oxopentanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1051-0144
benzyl 5-{13-[5-(benzyloxy)-5-oxopentanoyl]-1,4,10-trioxa-7,13-diazacyclopentadecan-7-yl}-5-oxopentanoate

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

1051-0144

Molecular Formula

C34H46N2O9 (C34 H46 N2 O9)

Compound Name

benzyl 5-{13-[5-(benzyloxy)-5-oxopentanoyl]-1,4,10-trioxa-7,13-diazacyclopentadecan-7-yl}-5-oxopentanoate

IUPAC name

benzyl 5-{13-[5-(benzyloxy)-5-oxopentanoyl]-1410-trioxa-713-diazacyclopentadecan-7-yl}-5-oxopentanoate

SMILES

O=C(CCCC(OCc1ccccc1)=O)N(CCOCC1)CCOCCOCCN1C(CCCC(OCc1ccccc1)=O)=O

InChI

InChI=1S/C34H46N2O9/c37-31(13-7-15-33(39)44-27-29-9-3-1-4-10-29)35-17-21-41-22-18-36(20-24-43-26-25-42-23-19-35)32(38)14-8-16-34(40)45-28-30-11-5-2-6-12-30/h1-6,9-12H,7-8,13-28H2

InChI Key

ZFVIAHKJCOCOGI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00301926

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

626.75

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

16.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.452

Distribution Coefficient, logD

2.452

Water Solubility, LogSw

-2.32

Polar Surface Area

97.413

Acid Dissociation Constant (pKa)

22.30

Base Dissociation Constant (pKb)

-0.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.90

References: we are preparing a list of scientific research reports with 1051-0144 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1051-0144?
Check Price and Availability of 1051-0144, 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 1051-0144 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1051-0144
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1051-0144
  • 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 1051-0144 available by request