0864-0117 Screening compound: BUTYL 1,4,7,10-TETRAOXA-13-AZACYCLOPENTADECANE-13-CARBOXYLATE

0864-0117 Screening compound: BUTYL 1,4,7,10-TETRAOXA-13-AZACYCLOPENTADECANE-13-CARBOXYLATE
0864-0117 Screening compound: BUTYL 1,4,7,10-TETRAOXA-13-AZACYCLOPENTADECANE-13-CARBOXYLATE alternative view

Chemical Structure Depiction of ChemDiv screening compound 0864-0117
BUTYL 1,4,7,10-TETRAOXA-13-AZACYCLOPENTADECANE-13-CARBOXYLATE

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

0864-0117

Molecular Formula

C15H29NO6 (C15 H29 NO6)

Compound Name

BUTYL 1,4,7,10-TETRAOXA-13-AZACYCLOPENTADECANE-13-CARBOXYLATE

IUPAC name

n/a

SMILES

CCCCOC(N1CCOCCOCCOCCOCC1)=O

InChI

InChI=1S/C15H29NO6/c1-2-3-6-22-15(17)16-4-7-18-9-11-20-13-14-21-12-10-19-8-5-16/h2-14H2,1H3

InChI Key

RHIBEJHUVMPOSC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00806412

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.229

Distribution Coefficient, logD

1.229

Water Solubility, LogSw

-1.10

Polar Surface Area

55.470

Acid Dissociation Constant (pKa)

28.32

Base Dissociation Constant (pKb)

1.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

0864-0117 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 0864-0117 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0864-0117?
Check Price and Availability of 0864-0117, 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 0864-0117 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0864-0117
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0864-0117
  • 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 0864-0117 available by request