1051-0164 Screening compound: ETHYL 5-OXO-5-(1,4,7-TRIOXA-10-AZACYCLODODECAN-10-YL)PENTANOATE

1051-0164 Screening compound: ETHYL 5-OXO-5-(1,4,7-TRIOXA-10-AZACYCLODODECAN-10-YL)PENTANOATE
1051-0164 Screening compound: ETHYL 5-OXO-5-(1,4,7-TRIOXA-10-AZACYCLODODECAN-10-YL)PENTANOATE alternative view

Chemical Structure Depiction of ChemDiv screening compound 1051-0164
ETHYL 5-OXO-5-(1,4,7-TRIOXA-10-AZACYCLODODECAN-10-YL)PENTANOATE

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

1051-0164

Molecular Formula

C15H27NO6 (C15 H27 NO6)

Compound Name

ETHYL 5-OXO-5-(1,4,7-TRIOXA-10-AZACYCLODODECAN-10-YL)PENTANOATE

IUPAC name

n/a

SMILES

CCOC(CCCC(N1CCOCCOCCOCC1)=O)=O

InChI

InChI=1S/C15H27NO6/c1-2-22-15(18)5-3-4-14(17)16-6-8-19-10-12-21-13-11-20-9-7-16/h2-13H2,1H3

InChI Key

UWVHRDRVULDRJA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00402277

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.38

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-0.187

Distribution Coefficient, logD

-0.187

Water Solubility, LogSw

0.43

Polar Surface Area

60.846

Acid Dissociation Constant (pKa)

22.88

Base Dissociation Constant (pKb)

-0.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.00

1051-0164 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1051-0164 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1051-0164?
Check Price and Availability of 1051-0164, 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 1051-0164 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1051-0164
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1051-0164
  • 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 1051-0164 available by request