D151-0399 Screening compound: 1-{4-cyano-2-[(1E)-2-(3-methoxyphenyl)ethenyl]-1,3-oxazol-5-yl}piperidine-4-carboxamide

D151-0399 Screening compound: 1-{4-cyano-2-[(1E)-2-(3-methoxyphenyl)ethenyl]-1,3-oxazol-5-yl}piperidine-4-carboxamide
D151-0399 Screening compound: 1-{4-cyano-2-[(1E)-2-(3-methoxyphenyl)ethenyl]-1,3-oxazol-5-yl}piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D151-0399
1-{4-cyano-2-[(1E)-2-(3-methoxyphenyl)ethenyl]-1,3-oxazol-5-yl}piperidine-4-carboxamide

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

D151-0399

Molecular Formula

C19H20N4O3 (C19 H20 N4 O3)

Compound Name

1-{4-cyano-2-[(1E)-2-(3-methoxyphenyl)ethenyl]-1,3-oxazol-5-yl}piperidine-4-carboxamide

IUPAC name

1-{4-cyano-2-[(1E)-2-(3-methoxyphenyl)ethenyl]-13-oxazol-5-yl}piperidine-4-carboxamide

SMILES

COc1cccc(/C=C/c2nc(C#N)c(N(CC3)CCC3C(N)=O)o2)c1

InChI

InChI=1S/C19H20N4O3/c1-25-15-4-2-3-13(11-15)5-6-17-22-16(12-20)19(26-17)23-9-7-14(8-10-23)18(21)24/h2-6,11,14H,7-10H2,1H3,(H2,21,24)

InChI Key

MGHDPTVMQUHBHY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06437688

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.438

Distribution Coefficient, logD

2.438

Water Solubility, LogSw

-2.78

Polar Surface Area

81.023

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

4.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.58

D151-0399 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D151-0399 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D151-0399?
Check Price and Availability of D151-0399, 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 D151-0399 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D151-0399
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D151-0399
  • 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 D151-0399 available by request