1419-0003 Screening compound: [3,4,6-tris(acetyloxy)-5-propanamidooxan-2-yl]methyl acetate

1419-0003 Screening compound: [3,4,6-tris(acetyloxy)-5-propanamidooxan-2-yl]methyl acetate
1419-0003 Screening compound: [3,4,6-tris(acetyloxy)-5-propanamidooxan-2-yl]methyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1419-0003
[3,4,6-tris(acetyloxy)-5-propanamidooxan-2-yl]methyl acetate

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

1419-0003

Molecular Formula

C17H25NO10 (C17 H25 NO10)

Compound Name

[3,4,6-tris(acetyloxy)-5-propanamidooxan-2-yl]methyl acetate

IUPAC name

[346-tris(acetyloxy)-5-propanamidooxan-2-yl]methyl acetate

SMILES

CCC(NC(C1OC(C)=O)C(OC(C)=O)OC(COC(C)=O)C1OC(C)=O)=O

InChI

InChI=1S/C17H25NO10/c1-6-13(23)18-14-16(26-10(4)21)15(25-9(3)20)12(7-24-8(2)19)28-17(14)27-11(5)22/h12,14-17H,6-7H2,1-5H3,(H,18,23)

InChI Key

CREWSAARWKDFND-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01364980

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.39

Hydrogen Bond Acceptors Count

15.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

0.233

Distribution Coefficient, logD

0.233

Water Solubility, LogSw

-0.93

Polar Surface Area

116.774

Acid Dissociation Constant (pKa)

15.28

Base Dissociation Constant (pKb)

-0.54

Number of Chiral Centers

5.00

Percent sp3 carbon bonding

70.60

1419-0003 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1419-0003 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1419-0003?
Check Price and Availability of 1419-0003, 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 1419-0003 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1419-0003
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1419-0003
  • 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 1419-0003 available by request