V016-8047 Screening compound: ethyl 3-[hexyl({[(1,2-oxazol-3-yl)carbamoyl]methyl})carbamoyl]propanoate

V016-8047 Screening compound: ethyl 3-[hexyl({[(1,2-oxazol-3-yl)carbamoyl]methyl})carbamoyl]propanoate
V016-8047 Screening compound: ethyl 3-[hexyl({[(1,2-oxazol-3-yl)carbamoyl]methyl})carbamoyl]propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-8047
ethyl 3-[hexyl({[(1,2-oxazol-3-yl)carbamoyl]methyl})carbamoyl]propanoate

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

V016-8047

Molecular Formula

C17H27N3O5 (C17 H27 N3 O5)

Compound Name

ethyl 3-[hexyl({[(1,2-oxazol-3-yl)carbamoyl]methyl})carbamoyl]propanoate

IUPAC name

ethyl 3-[hexyl({[(12-oxazol-3-yl)carbamoyl]methyl})carbamoyl]propanoate

SMILES

CCCCCCN(CC(Nc1nocc1)=O)C(CCC(OCC)=O)=O

InChI

InChI=1S/C17H27N3O5/c1-3-5-6-7-11-20(16(22)8-9-17(23)24-4-2)13-15(21)18-14-10-12-25-19-14/h10,12H,3-9,11,13H2,1-2H3,(H,18,19,21)

InChI Key

XCGFOCQFGZQMGX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14243908

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.42

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.869

Distribution Coefficient, logD

2.867

Water Solubility, LogSw

-3.03

Polar Surface Area

82.189

Acid Dissociation Constant (pKa)

9.58

Base Dissociation Constant (pKb)

-1.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

64.70

References: we are preparing a list of scientific research reports with V016-8047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-8047?
Check Price and Availability of V016-8047, 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 V016-8047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-8047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-8047
  • 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 V016-8047 available by request