C651-0156 Screening compound: 2-[3-(3-methoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]-1,2,3,4-tetrahydroisoquinoline

C651-0156 Screening compound: 2-[3-(3-methoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]-1,2,3,4-tetrahydroisoquinoline
C651-0156 Screening compound: 2-[3-(3-methoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]-1,2,3,4-tetrahydroisoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound C651-0156
2-[3-(3-methoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]-1,2,3,4-tetrahydroisoquinoline

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

C651-0156

Molecular Formula

C20H20N2O3 (C20 H20 N2 O3)

Compound Name

2-[3-(3-methoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]-1,2,3,4-tetrahydroisoquinoline

IUPAC name

2-[3-(3-methoxyphenyl)-45-dihydro-12-oxazole-5-carbonyl]-1234-tetrahydroisoquinoline

SMILES

COc1cccc(C(C2)=NOC2C(N(CC2)Cc3c2cccc3)=O)c1

InChI

InChI=1S/C20H20N2O3/c1-24-17-8-4-7-15(11-17)18-12-19(25-21-18)20(23)22-10-9-14-5-2-3-6-16(14)13-22/h2-8,11,19H,9-10,12-13H2,1H3/t19-/m0/s1

InChI Key

UEMXQRRIOPQXGL-IBGZPJMESA-N

MDL Number (MFCD)

MFCD08106252

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.463

Distribution Coefficient, logD

3.463

Water Solubility, LogSw

-3.67

Polar Surface Area

46.686

Acid Dissociation Constant (pKa)

15.75

Base Dissociation Constant (pKb)

-2.47

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

C651-0156 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with C651-0156 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C651-0156?
Check Price and Availability of C651-0156, 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 C651-0156 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C651-0156
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C651-0156
  • 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 C651-0156 available by request